SCHEMBL30127640

SCHEMBL30127640

Cc1c(F)ccc(Nc2ncnc3ccc(Cl)nc23)c1F

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
EGFR P00533 4/20 0.47
MKNK2 Q9HBH9 9/20 0.45
RAF1 P04049 2/20 0.43
BRAF P15056 2/20 0.43
ERBB2 P04626 1/20 0.41
KDR P35968 3/20 0.40
FGFR1 P11362 2/20 0.40
FLT1 P17948 2/20 0.40
EPHB2 P29323 1/20 0.40
FLT4 P35916 1/20 0.40
RET P07949 1/20 0.39
KIF5B P33176 1/20 0.39
DYRK1A Q13627 1/20 0.37
DYRK1B Q9Y463 1/20 0.37

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
SCHEMBL30127446 0.88 EGFR (0.50) EGFRMKNK2RAF1BRAFERBB2
SCHEMBL30126123 0.87 EGFR (0.49) EGFRMKNK2RAF1BRAFERBB2
SCHEMBL30127607 0.86 EGFR (0.50) EGFRMKNK2RAF1BRAFERBB2
SCHEMBL30126401 0.85 EGFR (0.54) EGFRMKNK2RAF1BRAFERBB2
SCHEMBL23538011 0.85 EGFR (0.54) EGFRMKNK2RAF1BRAFERBB2
SCHEMBL30126608 0.82 EGFR (0.47) EGFRMKNK2ERBB2
SCHEMBL30127456 0.82 EGFR (0.53) EGFRMKNK2KDRRETKIF5B
SCHEMBL30125903 0.82 EGFR (0.55) EGFRMKNK2RAF1BRAF
SCHEMBL30125912 0.82 KDR (0.55) EGFRMKNK2RAF1BRAFKDR
SCHEMBL30127533 0.81 EGFR (0.48) EGFRMKNK2RAF1BRAFKDR

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