SCHEMBL20980448

SCHEMBL20980448

Cc1cnc(-c2cccc(-c3ccc4cccn4c3)c2)cc1C

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IRAK4 Q9NWZ3 2/20 0.38
NPC1 O15118 10/20 0.35
ALDH1A1 P00352 9/20 0.35
RAB9A P51151 9/20 0.35
KDM4E B2RXH2 7/20 0.35
SMN1; SMN2 Q16637 6/20 0.35
POLB P06746 3/20 0.35
MAPT P10636 3/20 0.35
TP53 P04637 3/20 0.34
NPSR1 Q6W5P4 2/20 0.34
HSD17B10 Q99714 2/20 0.34
LDHA P00338 1/20 0.34
HPGD P15428 1/20 0.34
TSHR P16473 1/20 0.34
NFKB1 P19838 3/20 0.33
NFKB2 Q00653 3/20 0.33
RELA Q04206 3/20 0.33
GFER P55789 1/20 0.33
HSD17B1 P14061 1/20 0.33
HSD17B2 P37059 1/20 0.33

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
SCHEMBL25712542 0.86 ALDH1A1 (0.34) NPC1ALDH1A1RAB9AKDM4ESMN1; SMN2
SCHEMBL20980466 0.84 IRAK4 (0.32) IRAK4NPC1ALDH1A1RAB9AKDM4E
SCHEMBL20980471 0.79 NPC1 (0.43) NPC1ALDH1A1RAB9AKDM4ESMN1; SMN2
SCHEMBL20980544 0.75 WNK1 (0.34) IRAK4NPC1RAB9ASMN1; SMN2LDHA
SCHEMBL13834213 0.75 LDHA (0.51) IRAK4NPC1ALDH1A1RAB9AKDM4E
SCHEMBL20980501 0.73 IRAK4 (0.35) IRAK4NPC1LDHAHSD17B1HSD17B2
SCHEMBL25712553 0.71 GRM5 (0.32)
SCHEMBL20980496 0.70 RAB9A (0.39) NPC1ALDH1A1RAB9AKDM4ESMN1; SMN2
SCHEMBL20980504 0.70 GRM4 (0.32) NPC1ALDH1A1RAB9AKDM4ESMN1; SMN2
SCHEMBL20980515 0.70 GRM4 (0.32) NPC1ALDH1A1RAB9AKDM4ESMN1; 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11685756-B2 Organic electroluminescent materials and devices UNIVERSAL DISPLAY CORPORATION (US) 2023-06-27 US disclosed
US-11685756-B2 Organic electroluminescent materials and devices UNIVERSAL DISPLAY CORPORATION (US) 2023-06-27 US disclosed
US-11214587-B2 Organic electroluminescent materials and devices UNIVERSAL DISPLAY CORPORATION (US) 2022-01-04 US disclosed
US-20190135843-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2019-05-09 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 (3 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-11685756-B2 Organic electroluminescent materials and devices OCIAD1, OCIAD2, OPRD1 IRAK4 4374/4885NPC1 3147/4885ALDH1A1 2254/4885
US-11214587-B2 Organic electroluminescent materials and devices OCIAD1, OCIAD2, OPRD1 IRAK4 4374/4885NPC1 3147/4885ALDH1A1 2254/4885
US-20190135843-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES OCIAD1, OCIAD2, OPRD1 IRAK4 4374/4885NPC1 3147/4885ALDH1A1 2254/4885

“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.