SCHEMBL10028259

SCHEMBL10028259

COc1c(-c2ncc(-c3ccccc3)cc2C(=O)O)ccc2ccccc12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 4/20 0.42
CYP1A1 P04798 1/20 0.41
CYP1B1 Q16678 1/20 0.41
RAB9A P51151 3/20 0.41
AXL P30530 1/20 0.40
PDE10A Q9Y233 1/20 0.40
IKBKB O14920 1/20 0.40
HPGD P15428 3/20 0.39
NPC1 O15118 2/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
FYN P06241 1/20 0.39
KDM4E B2RXH2 4/20 0.39
ALDH1A1 P00352 3/20 0.39
LMNA P02545 1/20 0.39
MAPT P10636 1/20 0.39
NFKB1 P19838 1/20 0.39
NFKB2 Q00653 1/20 0.39
RELA Q04206 1/20 0.39
ATM Q13315 1/20 0.39

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
SCHEMBL10000579 0.84 CAMKK2 (0.43) DHODHPDE10AHPGDMEN1KMT2A
SCHEMBL10027756 0.81 KDM4E (0.50) DHODHCYP1A1CYP1B1RAB9AHPGD
SCHEMBL16975588 0.80 KDM4E (0.46) DHODHCYP1A1CYP1B1RAB9AHPGD
SCHEMBL10028254 0.79 ALDH1A1 (0.45) HPGDKMT2AFYNKDM4EALDH1A1
SCHEMBL10027991 0.78 CTSD (0.42) DHODHCYP1A1CYP1B1RAB9AHPGD
SCHEMBL10028000 0.77 DHODH (0.51) DHODHRAB9APDE10AHPGDNPC1
SCHEMBL10028256 0.73 FYN (0.43) DHODHHPGDMEN1KMT2AFYN
SCHEMBL10000590 0.72 MCL1 (0.53) DHODHHPGDMEN1KMT2AKDM4E
SCHEMBL1671110 0.72 CYP1A1 (0.64) CYP1A1CYP1B1RAB9AHPGDNPC1
SCHEMBL6112483 0.72 ABCG2 (0.48) CYP1A1CYP1B1RAB9AHPGDMEN1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150340628-A1 METAL COMPLEX COMPOUND AND ORGANIC LIGHT EMITTING DIODE DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO LTD (KR) 2015-11-26 US disclosed
US-9096529-B2 Metal complex compound and organic light emitting diode device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2015-08-04 US disclosed
US-20120012824-A1 METAL COMPLEX COMPOUND AND ORGANIC LIGHT EMITTING DIODE DEVICE INCLUDING THE SAME SAMSUNG MOBILE DISPLAY CO., LTD. (KR) 2012-01-19 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 (2 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-20150340628-A1 METAL COMPLEX COMPOUND AND ORGANIC LIGHT EMITTING DIODE DEVICE INCLUDING THE SAME AP1M1, MT-CO1, AP2M1 DHODH 2065/4885CYP1A1 41/4885CYP1B1 84/4885
US-20120012824-A1 METAL COMPLEX COMPOUND AND ORGANIC LIGHT EMITTING DIODE DEVICE INCLUDING THE SAME AP1M1, MT-CO1, AP2M1 DHODH 2065/4885CYP1A1 41/4885CYP1B1 84/4885

“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.