SCHEMBL7595199

SCHEMBL7595199

COc1cc2cnc(Nc3ccc(O)cc3Br)nc2cc1OC

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 1/20 0.43
PDGFRA P16234 1/20 0.43
KDM4E B2RXH2 1/20 0.43
ALDH1A1 P00352 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
SRC P12931 1/20 0.42
CSF1R P07333 1/20 0.40
RET P07949 4/20 0.40
KDR P35968 4/20 0.40
KIF5B P33176 3/20 0.40
EGFR P00533 3/20 0.39
ERBB2 P04626 1/20 0.39
ALK Q9UM73 2/20 0.39
MAP2K1 Q02750 1/20 0.38
LRRK2 Q5S007 4/20 0.38
BRAF P15056 1/20 0.38
FGFR1 P11362 1/20 0.38
AURKA O14965 1/20 0.38
GAK O14976 1/20 0.38
RIPK2 O43353 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
SCHEMBL7766729 0.86 MEN1 (0.46) PDGFRBPDGFRAKDM4EALDH1A1SMN1; SMN2
SCHEMBL7801874 0.85 KDM4E (0.49) PDGFRBPDGFRAKDM4EALDH1A1SMN1; SMN2
SCHEMBL7790969 0.84 EGFR (0.55) KDM4EALDH1A1SMN1; SMN2CSF1REGFR
SCHEMBL360021 0.81 EGFR (0.53) PDGFRBPDGFRAKDM4EALDH1A1SMN1; SMN2
SCHEMBL7799373 0.79 EGFR (0.44) KDM4EALDH1A1SMN1; SMN2CSF1RRET
SCHEMBL7797381 0.79 KDM4E (0.43) PDGFRBPDGFRAKDM4EALDH1A1SMN1; SMN2
SCHEMBL1539121 0.79 RET (0.55) KDM4EALDH1A1SMN1; SMN2RETKDR
SCHEMBL1246693 0.78 ABCG2 (0.58) KDM4EALDH1A1SMN1; SMN2RETKDR
SCHEMBL7797258 0.78 KDR (0.59) PDGFRBPDGFRAKDM4EALDH1A1SMN1; SMN2
SCHEMBL7753469 0.78 FGFR1 (0.56) PDGFRBPDGFRARETKDRKIF5B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2002043735-A1 INHIBITORS OF THROMBIN INDUCED PLATELET AGGREGATION PARKER HUGHES INSTITUTE (US) 2002-06-06 WO claimed