SCHEMBL7980495

SCHEMBL7980495

COc1cc2c3ccc(OC)c(OC)c3c(=O)n(Cc3ccc(Cl)c(Cl)c3)c2cc1OC

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SRC P12931 2/20 0.49
PRKACA P17612 1/20 0.49
PRKACG P22612 1/20 0.49
PRKACB P22694 1/20 0.49
CCR2 P41597 6/20 0.46
ABCB11 O95342 1/20 0.44
KDM4E B2RXH2 2/20 0.41
THRB P10828 2/20 0.41
ALDH1A1 P00352 1/20 0.41
BLM P54132 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
PDE7A Q13946 1/20 0.40
TSHR P16473 2/20 0.39
MAPT P10636 2/20 0.38
RXFP1 Q9HBX9 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
ATM Q13315 1/20 0.38

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
SCHEMBL7980591 0.86 TSHR (0.52) SRCKDM4ETHRBALDH1A1TSHR
SCHEMBL7983884 0.85 SRC (0.67) SRCPRKACAPRKACGPRKACBCCR2
SCHEMBL7981786 0.83 SRC (0.56) SRCPRKACAPRKACGPRKACBKDM4E
SCHEMBL7987028 0.81 SRC (0.57) SRCPRKACAPRKACGPRKACBKDM4E
SCHEMBL7981431 0.80 SRC (0.48) SRCKDM4EALDH1A1SMN1; SMN2TSHR
SCHEMBL7987031 0.72 NOX4 (0.54) SRCPRKACAPRKACGPRKACBTSHR
SCHEMBL7987637 0.70 SRC (0.74) SRCPRKACAPRKACGPRKACBCCR2
SCHEMBL7980285 0.70 SRC (0.49) SRCKDM4ETHRBALDH1A1BLM
SCHEMBL7970086 0.70 SRC (0.63) SRCPRKACAPRKACGPRKACBKDM4E
SCHEMBL7970968 0.69 TSHR (0.47) SRCKDM4EALDH1A1SMN1; SMN2TSHR

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