SCHEMBL8992258

SCHEMBL8992258

Cc1c(C2=CC(=O)C(=O)c3ccccc32)c2ccccc2n1C

nearest known ligand 0.58

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PTPRC P08575 7/20 0.58
NTRK1 P04629 3/20 0.51
NSD2 O96028 1/20 0.48
OPRM1 P35372 1/20 0.48
OPRD1 P41143 1/20 0.48
HKDC1 Q2TB90 1/20 0.48
PTPN1 P18031 7/20 0.48
KDM4E B2RXH2 2/20 0.48
ALDH1A1 P00352 1/20 0.48
GLA P06280 1/20 0.48
GAA P10253 1/20 0.48
HPGD P15428 1/20 0.48
CYP2C19 P33261 1/20 0.48
HTT P42858 1/20 0.48
HSD17B10 Q99714 1/20 0.48
PTPRF P10586 2/20 0.45
CDC25B P30305 2/20 0.45
NQO2 P16083 1/20 0.43

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
SCHEMBL9562520 0.89 NTRK1 (0.51) PTPRCNTRK1KDM4EALDH1A1GLA
SCHEMBL9562391 0.80 NTRK1 (0.54) NTRK1KDM4EALDH1A1GLAGAA
SCHEMBL7719612 0.78 S100A4 (0.44) PTPRCNTRK1NSD2KDM4EALDH1A1
SCHEMBL29094065 0.77 CCR6 (0.51) NTRK1HKDC1KDM4EALDH1A1GLA
SCHEMBL6237555 0.74 PTPRC (1.00) PTPRCPTPN1PTPRFCDC25B
SCHEMBL18392178 0.73 KDM4E (0.61) NTRK1KDM4EALDH1A1GLAGAA
SCHEMBL8992318 0.71 PTPRC (0.70) PTPRCNSD2OPRM1OPRD1HKDC1
SCHEMBL8992603 0.71 PTPRC (0.50) PTPRCNTRK1NSD2OPRM1OPRD1
SCHEMBL17698003 0.70 NTRK1 (0.66) NTRK1CYP2C19HSD17B10
SCHEMBL27353563 0.70 NTRK1 (0.76) NTRK1KDM4EALDH1A1CYP2C19HSD17B10

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
EP-0560682-B1 Keratinous fibres dye compositions with 4-monoindolyl 1,2-naphthochinones, 4-monoindolyl 1,2-naphthoquinones OREAL (FR) 1996-08-07 EP claimed
EP-0560682-A1 Keratinous fibres dye compositions with 4-monoindolyl 1,2-naphthochinones, 4-monoindolyl 1,2-naphthoquinones L'OREAL (FR) 1993-09-15 EP claimed
EP-0560682-B1 Keratinous fibres dye compositions with 4-monoindolyl 1,2-naphthochinones, 4-monoindolyl 1,2-naphthoquinones OREAL (FR) 1996-08-07 EP disclosed
EP-0560682-A1 Keratinous fibres dye compositions with 4-monoindolyl 1,2-naphthochinones, 4-monoindolyl 1,2-naphthoquinones L'OREAL (FR) 1993-09-15 EP disclosed