SCHEMBL30140140

SCHEMBL30140140

Clc1cc(Nc2ncnc3ccc(O[C@H]4CCNC4)nc23)ccc1OC[C@@H]1CCOC1

nearest known ligand 0.45

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
EGFR P00533 11/20 0.45
ERBB2 P04626 5/20 0.45
EPHA2 P29317 7/20 0.41
KDR P35968 5/20 0.40
EPHB4 P54760 5/20 0.40
GRM4 Q14833 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
SCHEMBL30140203 1.00 EGFR (0.45) EGFRERBB2EPHA2KDREPHB4
SCHEMBL30140321 0.95 EGFR (0.46) EGFRERBB2EPHA2KDREPHB4
SCHEMBL30140393 0.87 EGFR (0.41) EGFRERBB2EPHA2KDREPHB4
SCHEMBL30140304 0.86 EPHA2 (0.49) EGFRERBB2EPHA2KDREPHB4
SCHEMBL30140165 0.85 EGFR (0.46) EGFRERBB2EPHA2KDREPHB4
SCHEMBL30140131 0.85 EGFR (0.46) EGFRERBB2EPHA2KDREPHB4
SCHEMBL30140124 0.85 ERBB2 (0.49) EGFRERBB2EPHA2KDREPHB4
SCHEMBL30126544 0.84 EGFR (0.46) EGFRERBB2EPHA2KDREPHB4
SCHEMBL30125859 0.84 EGFR (0.46) EGFRERBB2EPHA2KDREPHB4
SCHEMBL30127180 0.84 EGFR (0.46) EGFRERBB2EPHA2KDREPHB4

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