SCHEMBL30125973

SCHEMBL30125973

N#Cc1ccc(Nc2ncnc3ccc(Cl)nc23)c(F)c1Cl

nearest known ligand 0.45

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
EGFR P00533 8/20 0.45
MKNK2 Q9HBH9 9/20 0.41
RAF1 P04049 1/20 0.36
BRAF P15056 1/20 0.36
RPS6KA5 O75582 1/20 0.34
RPS6KA4 O75676 1/20 0.34
ERBB2 P04626 1/20 0.33

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
SCHEMBL30126849 0.91 EGFR (0.45) EGFRMKNK2RAF1BRAFRPS6KA5
SCHEMBL23538011 0.84 EGFR (0.54) EGFRMKNK2RAF1BRAFERBB2
SCHEMBL30126123 0.84 EGFR (0.49) EGFRMKNK2RAF1BRAFERBB2
SCHEMBL30126401 0.84 EGFR (0.54) EGFRMKNK2RAF1BRAFERBB2
SCHEMBL30126870 0.82 EGFR (0.47) EGFRMKNK2RAF1BRAF
SCHEMBL30127446 0.80 EGFR (0.50) EGFRMKNK2RAF1BRAFERBB2
SCHEMBL30127607 0.80 EGFR (0.50) EGFRMKNK2RAF1BRAFERBB2
SCHEMBL30127372 0.79 MKNK2 (0.46) EGFRMKNK2RAF1BRAFERBB2
SCHEMBL30127533 0.78 EGFR (0.48) EGFRMKNK2RAF1BRAF
SCHEMBL30127640 0.77 EGFR (0.47) EGFRMKNK2RAF1BRAFERBB2

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-2022266458-A1 6-HETEROCYCLOALKYL-QUINAZOLINE DERIVATIVES AND USES THEREOF BLACK DIAMOND THERAPEUTICS, INC. (US) 2022-12-22 WO disclosed