SCHEMBL7987496

SCHEMBL7987496

O=c1[nH]c2cc(O)c(O)cc2c2cc(O)c(O)cc12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SRC P12931 4/20 1.00
PRKACA P17612 3/20 0.65
PRKACG P22612 3/20 0.65
PRKACB P22694 3/20 0.65
GPR35 Q9HC97 2/20 0.44
DAO P14920 5/20 0.43
DDO Q99489 3/20 0.43
PARP1 P09874 3/20 0.42

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
SCHEMBL7984052 0.84 SRC (0.71) SRCPRKACAPRKACGPRKACBDAO
SCHEMBL28853705 0.80 SRC (0.67) SRCPRKACAPRKACGPRKACBGPR35
SCHEMBL3883791 0.80 SRC (1.00) SRCPRKACAPRKACGPRKACBGPR35
SCHEMBL7980275 0.79 SRC (0.66) SRCDAODDOPARP1
SCHEMBL7784305 0.78 SRC (0.62) SRCPRKACAPRKACGPRKACBDAO
SCHEMBL7984263 0.75 SRC (1.00) SRCPRKACAPRKACGPRKACBDAO
SCHEMBL2547457 0.74 SRC (0.58) SRCPRKACAPRKACGPRKACBPARP1
SCHEMBL26775605 0.72 SRC (0.54) SRCPRKACAPRKACGPRKACBDAO
SCHEMBL26775390 0.72 SRC (0.54) SRCPRKACAPRKACGPRKACBDAO
SCHEMBL26768902 0.72 SRC (0.54) SRCPRKACAPRKACGPRKACBDAO

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