SCHEMBL7983836

SCHEMBL7983836

COc1cc2c3ccc(OC)c(OC)c3n(C(=O)c3ccc4ccccc4c3)c2cc1OC

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SRC P12931 1/20 0.55
PRKACA P17612 1/20 0.55
PRKACG P22612 1/20 0.55
PRKACB P22694 1/20 0.55
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
ABCG2 Q9UNQ0 4/20 0.43
ABCB1 P08183 1/20 0.43
AKR1C3 P42330 1/20 0.42
NQO2 P16083 1/20 0.42
CASP3 P42574 1/20 0.42
SENP7 Q9BQF6 1/20 0.42
POLB P06746 1/20 0.41
ALDH1A1 P00352 1/20 0.39
MAPT P10636 1/20 0.39
HTT P42858 1/20 0.39
F12 P00748 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
SCHEMBL7987262 0.87 SRC (0.50) SRCPRKACAPRKACGPRKACBNPC1
SCHEMBL7988065 0.85 SRC (0.54) SRCPRKACAPRKACGPRKACBNPC1
SCHEMBL7971057 0.83 SRC (0.52) SRCPRKACAPRKACGPRKACBNPC1
SCHEMBL7981595 0.82 SRC (0.55) SRCPRKACAPRKACGPRKACBNPC1
SCHEMBL7970249 0.80 SRC (0.57) SRCPRKACAPRKACGPRKACB
SCHEMBL7983604 0.79 SRC (0.58) SRCPRKACAPRKACGPRKACBRAB9A
SCHEMBL7970472 0.73 SRC (0.55) SRCPRKACAPRKACGPRKACBNPC1
SCHEMBL7981392 0.72 SRC (0.61) SRCNPC1RAB9AALDH1A1MAPT
SCHEMBL5074187 0.68 CYP1A2 (0.73) NPC1RAB9AAKR1C3NQO2CASP3
SCHEMBL8499452 0.68 CYP1A2 (0.73) NPC1RAB9AAKR1C3NQO2CASP3

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 2 patents. claimed = in the patent's claims; disclosed = body only.

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