SCHEMBL9350768

SCHEMBL9350768

COc1ccc2cc(C)[nH]c2c1O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 2/20 0.40
AXL P30530 1/20 0.40
AMY1A P0DUB6 2/20 0.39
SMPD3 Q9NY59 5/20 0.38
TDO2 P48775 3/20 0.38
MAPT P10636 3/20 0.38
KDM4E B2RXH2 2/20 0.38
TP53 P04637 2/20 0.38
ALDH1A1 P00352 2/20 0.38
LMNA P02545 1/20 0.38
CYP3A4 P08684 1/20 0.38
HPGD P15428 1/20 0.38
ALOX15 P16050 1/20 0.38
ALOX12 P18054 1/20 0.38
MAPK1 P28482 1/20 0.38
HSD17B10 Q99714 1/20 0.38
IDO1 P14902 2/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
POLB P06746 1/20 0.37

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
SCHEMBL29254167 0.82 AXL (0.40) AXLAMY1AMAPTKDM4ETP53
SCHEMBL29254178 0.77 CA9 (0.47) MCL1MAPTKDM4ETP53ALDH1A1
SCHEMBL9315216 0.77 HPGD (0.60) TDO2MAPTKDM4EALDH1A1LMNA
SCHEMBL9315345 0.75 ESR1 (0.41) MCL1AXLMAPTKDM4EALDH1A1
SCHEMBL29254187 0.75 KDM4E (0.41) AXLMAPTKDM4EALDH1A1LMNA
SCHEMBL476670 0.74 ITK (0.48) MCL1AXLMAPTKDM4EALDH1A1
SCHEMBL4406397 0.73 CNR2 (0.62) MAPTKDM4EALDH1A1HPGDHSD17B10
SCHEMBL4429156 0.73 KDM4E (0.44) AXLMAPTKDM4EALDH1A1LMNA
SCHEMBL29254170 0.72 LMNA (0.50) MAPTKDM4ETP53ALDH1A1LMNA
SCHEMBL9315401 0.71 ALDH1A1 (0.46) MCL1AXLAMY1AMAPTKDM4E

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-0428442-B1 Composition comprising derivatives of 6- or 7-hydroxyindole as couplers and dyeing processes using same OREAL (FR) 1994-08-31 EP claimed
EP-0428442-A1 Composition comprising derivatives of 6- or 7-hydroxyindole as couplers and dyeing processes using same L'OREAL (FR) 1991-05-22 EP claimed
EP-0428442-B1 Composition comprising derivatives of 6- or 7-hydroxyindole as couplers and dyeing processes using same OREAL (FR) 1994-08-31 EP disclosed
EP-0428442-A1 Composition comprising derivatives of 6- or 7-hydroxyindole as couplers and dyeing processes using same L'OREAL (FR) 1991-05-22 EP disclosed