SCHEMBL30140209

SCHEMBL30140209

Fc1c(Nc2ncnc3ccc(O[C@H]4CCNC4)nc23)ccc(OC[C@H]2CCCO2)c1Cl

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
EPHA2 P29317 14/20 0.41
EGFR P00533 1/20 0.40
KDR P35968 9/20 0.38
MKNK2 Q9HBH9 1/20 0.38
EPHB4 P54760 7/20 0.37
ERBB2 P04626 7/20 0.37
FLT1 P17948 5/20 0.37
RET P07949 1/20 0.36
KIF5B P33176 1/20 0.36

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
SCHEMBL30140098 1.00 EPHA2 (0.41) EPHA2EGFRKDRMKNK2EPHB4
SCHEMBL30140390 1.00 EPHA2 (0.41) EPHA2EGFRKDRMKNK2EPHB4
SCHEMBL30140065 0.98 EPHA2 (0.41) EPHA2EGFRKDRMKNK2EPHB4
SCHEMBL30140177 0.98 EPHA2 (0.41) EPHA2EGFRKDRMKNK2EPHB4
SCHEMBL30140289 0.96 EPHA2 (0.43) EPHA2KDRMKNK2EPHB4ERBB2
SCHEMBL30140291 0.96 EPHA2 (0.43) EPHA2KDRMKNK2EPHB4ERBB2
SCHEMBL30140102 0.93 EPHA2 (0.40) EPHA2EGFRKDRMKNK2EPHB4
SCHEMBL30140250 0.93 EPHA2 (0.40) EPHA2EGFRKDRMKNK2EPHB4
SCHEMBL30140062 0.88 EGFR (0.42) EPHA2EGFRKDRMKNK2EPHB4
SCHEMBL30140443 0.88 EGFR (0.41) EPHA2EGFRKDRMKNK2EPHB4

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-2022266426-A1 6-(HETEROCYCLOALKYL-OXY)-QUINAZOLINE DERIVATIVES AND USES THEREOF BLACK DIAMOND THERAPEUTICS, INC. (US) 2022-12-22 WO disclosed