SCHEMBL74782

SCHEMBL74782

CC(C)(C)c1ccc(-c2ccc(-c3nnc(-c4ccccc4)o3)cc2)cc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
S1PR1 P21453 1/20 0.67
NPC1 O15118 13/20 0.64
RAB9A P51151 13/20 0.64
KDM4E B2RXH2 4/20 0.64
SMN1; SMN2 Q16637 7/20 0.63
HPGD P15428 6/20 0.61
POLB P06746 2/20 0.61
NFKB1 P19838 1/20 0.61
NFKB2 Q00653 1/20 0.61
RELA Q04206 1/20 0.61
TP53 P04637 2/20 0.60
EGFR P00533 1/20 0.60
ALDH1A1 P00352 4/20 0.59
GLA P06280 1/20 0.59
MAPT P10636 1/20 0.59
ALOX15 P16050 1/20 0.59
HSD17B10 Q99714 1/20 0.59
MEN1 O00255 1/20 0.56
KMT2A Q03164 1/20 0.56
NR1H4 Q96RI1 1/20 0.54

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL2623779 1.00 S1PR1 (0.67) S1PR1NPC1RAB9AKDM4ESMN1; SMN2
SCHEMBL28982567 1.00 S1PR1 (0.67) S1PR1NPC1RAB9AKDM4ESMN1; SMN2
SCHEMBL8385439 1.00 S1PR1 (0.67) S1PR1NPC1RAB9AKDM4ESMN1; SMN2
Biphenyl SCHEMBL28899764 1.00 S1PR1 (0.67) S1PR1NPC1RAB9AKDM4ESMN1; SMN2
SCHEMBL36912 1.00 S1PR1 (0.67) S1PR1NPC1RAB9AKDM4ESMN1; SMN2
SCHEMBL2839508 0.98 S1PR1 (0.69) S1PR1NPC1RAB9AKDM4ESMN1; SMN2
SCHEMBL1104799 0.92 NPC1 (0.72) S1PR1NPC1RAB9AKDM4ESMN1; SMN2
SCHEMBL6296907 0.92 NPC1 (0.72) S1PR1NPC1RAB9AKDM4ESMN1; SMN2
SCHEMBL1421139 0.92 S1PR1 (0.58) S1PR1NPC1RAB9AKDM4ESMN1; SMN2
SCHEMBL12354585 0.91 S1PR1 (0.61) S1PR1NPC1RAB9AKDM4ESMN1; SMN2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 375 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12022728-B2 Organic electroluminescent element and electronic device IDEMITSU KOSAN CO., LTD. (JP) 2024-06-25 US disclosed
US-11751472-B2 Aromatic amine derivative and elecroluminescence device using the same IDEMITSU KOSAN CO., LTD. (JP) 2023-09-05 US disclosed
US-11751472-B2 Aromatic amine derivative and elecroluminescence device using the same IDEMITSU KOSAN CO., LTD. (JP) 2023-09-05 US disclosed
US-11691983-B2 Specifically substituted benzofuro- and benzothienoquinolines for organic light emitting diodes IDEMITSU KOSAN CO., LTD. (JP) 2023-07-04 US disclosed
US-11678571-B2 Organic electroluminescent device using aryl amine derivative containing heterocycle IDEMITSU KOSAN CO., LTD. (JP) 2023-06-13 US disclosed
US-11678571-B2 Organic electroluminescent device using aryl amine derivative containing heterocycle IDEMITSU KOSAN CO., LTD. (JP) 2023-06-13 US disclosed
US-11538997-B2 Aromatic amine derivative and electroluminescence device using the same IDEMITSU KOSAN CO., LTD. (JP) 2022-12-27 US disclosed
US-20210384446-A1 AROMATIC AMINE DERIVATIVE AND ORGANIC ELECTROLUMINESCENT DEVICE USING THE SAME IDEMITSU KOSAN CO., LTD. (JP) 2021-12-09 US disclosed
US-20210376247-A1 ORGANIC ELECTROLUMINESCENT DEVICE USING ARYL AMINE DERIVATIVE CONTAINING HETEROCYCLE IDEMITSU KOSAN CO., LTD. (JP) 2021-12-02 US disclosed
US-11152574-B2 Organic electroluminescent device using aryl amine derivative containing heterocycle IDEMITSU KOSAN CO., LTD. (JP) 2021-10-19 US disclosed
US-20080145707-A1 AROMATIC AMINE DERIVATIVE AND ORGANIC ELECTROLUMINESCENCE DEVICE USING THE SAME IDEMITSU KOSAN CO., LTD. (JP) 2008-06-19 US disclosed
US-20080106190-A1 AROMATIC AMINE DERIVATIVES AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME IDEMITSU KOSAN CO., LTD. (JP) 2008-05-08 US disclosed
US-20080076942-A1 AROMATIC AMINE DERIVATIVE AND ORGANIC ELECTROLUMINESCENCE DEVICE USING THE SAME IDEMITSU KOSAN CO., LTD. (JP) 2008-03-27 US disclosed
US-20080049413-A1 Organic electroluminescence device IDEMITSU KOSAN CO., LTD. (JP) 2008-02-28 US disclosed
US-20070247066-A1 Electrode Substrate and Its Manufacturing Method IDEMITSU KOSAN CO., LTD. (JP) 2007-10-25 US disclosed
US-20070247066-A1 Electrode Substrate and Its Manufacturing Method IDEMITSU KOSAN CO., LTD. (JP) 2007-10-25 US disclosed
US-20070145888-A1 AROMATIC AMINE DERIVATIVES AND ORGANIC ELECTROLUMINESCENCE DEVICE USING THE SAME IDEMITSU KOSAN CO., LTD. (JP) 2007-06-28 US disclosed
US-20070134511-A1 Organic electroluminescence device IDEMITSU KOSAN CO., LTD. (JP) 2007-06-14 US disclosed
US-20070088185-A1 Anthrylarylene derivative, material for organic electroluminescence device and organic electroluminescence device using same IDEMITSU KOSAN CO., LTD. (JP) 2007-04-19 US disclosed
US-20070013296-A1 Biphenyl derivative, material for organic electroluminescence device, and organic electroluminescence device using the same IDEMITSU KOSAN CO., LTD. (JP) 2007-01-18 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (14 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-11152574-B2 Organic electroluminescent device using aryl amine derivative containing heterocycle RPL21, RPS21, AOC2 S1PR1 4478/4885NPC1 3134/4885RAB9A 1672/4885
US-20080076942-A1 AROMATIC AMINE DERIVATIVE AND ORGANIC ELECTROLUMINESCENCE DEVICE USING THE SAME TYR, MAOA, DDC S1PR1 4503/4885NPC1 4722/4885RAB9A 2826/4885
US-11678571-B2 Organic electroluminescent device using aryl amine derivative containing heterocycle RPS17, RPS19, CDK17 S1PR1 4867/4885NPC1 4654/4885RAB9A 1510/4885
US-11751472-B2 Aromatic amine derivative and elecroluminescence device using the same ALK, ALKBH3, ACVRL1 S1PR1 4473/4885NPC1 4823/4885RAB9A 3793/4885
US-11691983-B2 Specifically substituted benzofuro- and benzothienoquinolines for organic light emitting diodes KCNQ2, KCNQ1, KCNQ4 S1PR1 4069/4885NPC1 2663/4885RAB9A 2910/4885
US-20080106190-A1 AROMATIC AMINE DERIVATIVES AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME EML4, SLC18A2, SLC18A3 S1PR1 4213/4885NPC1 2160/4885RAB9A 2776/4885
US-11538997-B2 Aromatic amine derivative and electroluminescence device using the same EML4, DDC, TYR S1PR1 4524/4885NPC1 4716/4885RAB9A 3225/4885
US-20210384446-A1 AROMATIC AMINE DERIVATIVE AND ORGANIC ELECTROLUMINESCENT DEVICE USING THE SAME DDT, TYR, DDC S1PR1 4779/4885NPC1 4655/4885RAB9A 3940/4885
US-20070145888-A1 AROMATIC AMINE DERIVATIVES AND ORGANIC ELECTROLUMINESCENCE DEVICE USING THE SAME EML4, TYR, ALKBH3 S1PR1 4261/4885NPC1 3992/4885RAB9A 2528/4885
US-20070088185-A1 Anthrylarylene derivative, material for organic electroluminescence device and organic electroluminescence device using same RABGGTA, ALAD, GCDH S1PR1 4870/4885NPC1 4588/4885RAB9A 1756/4885
US-20210376247-A1 ORGANIC ELECTROLUMINESCENT DEVICE USING ARYL AMINE DERIVATIVE CONTAINING HETEROCYCLE RPS17, RPS19, CDK17 S1PR1 4867/4885NPC1 4654/4885RAB9A 1510/4885
US-20080145707-A1 AROMATIC AMINE DERIVATIVE AND ORGANIC ELECTROLUMINESCENCE DEVICE USING THE SAME H1-0, H1-2, H1-4 S1PR1 3023/4885NPC1 2506/4885RAB9A 1684/4885
US-12022728-B2 Organic electroluminescent element and electronic device L1CAM, ESR1, LEF1 S1PR1 2340/4885NPC1 1857/4885RAB9A 1517/4885
US-20070013296-A1 Biphenyl derivative, material for organic electroluminescence device, and organic electroluminescence device using the same EED, BMI1, EBPL S1PR1 4398/4885NPC1 4338/4885RAB9A 2778/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.