SCHEMBL7970086

SCHEMBL7970086

COc1cc2c(=O)n(Cc3ccccc3)c3cc(OC)c(OC)cc3c2cc1OC

nearest known ligand 0.63

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SRC P12931 2/20 0.63
TSHR P16473 1/20 0.62
ALDH1A1 P00352 6/20 0.60
MAPT P10636 6/20 0.57
KDM4E B2RXH2 5/20 0.57
HPGD P15428 2/20 0.52
HSD17B10 Q99714 2/20 0.52
PRKACA P17612 1/20 0.50
PRKACG P22612 1/20 0.50
PRKACB P22694 1/20 0.50
KMT2A Q03164 1/20 0.50
EDNRB P24530 1/20 0.49
EDNRA P25101 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.48
TP53 P04637 1/20 0.47

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
SCHEMBL9370571 0.88 SRC (0.57) SRCTSHRALDH1A1MAPTKDM4E
SCHEMBL7970466 0.88 SRC (0.69) SRCTSHRALDH1A1MAPTKDM4E
SCHEMBL7983884 0.84 SRC (0.67) SRCTSHRALDH1A1MAPTKDM4E
SCHEMBL7984333 0.84 MAPT (0.53) SRCTSHRALDH1A1MAPTKDM4E
SCHEMBL7980591 0.83 TSHR (0.52) SRCTSHRALDH1A1MAPTKDM4E
SCHEMBL7981572 0.82 NOX4 (0.68) SRCTSHRALDH1A1KDM4EPRKACA
SCHEMBL7980611 0.82 SRC (0.60) SRCTSHRALDH1A1MAPTKDM4E
SCHEMBL7970469 0.78 NOX4 (0.71) SRCTSHRALDH1A1MAPTPRKACA
SCHEMBL9367302 0.78 SRC (1.00) SRCALDH1A1MAPTKDM4EPRKACA
SCHEMBL7970968 0.77 TSHR (0.47) SRCTSHRALDH1A1MAPTKDM4E

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-6194439-B1 ANTICANCER AGENT PFIZER INC. 2001-02-27 US disclosed
EP-0586608-A1 TRICYCLIC POLYHYDROXYLIC TYROSINE KINASE INHIBITORS PFIZER INC. (US) 1994-03-16 EP disclosed
WO-1992021660-A1 TRICYCLIC POLYHYDROXYLIC TYROSINE KINASE INHIBITORS PFIZER, INC. (US) 1992-12-10 WO disclosed