SCHEMBL31472883

SCHEMBL31472883

O=[N+]([O-])c1cc2c(Nc3cc(Cl)ccc3F)ncnc2cc1F

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDR P35968 4/20 0.50
FLT1 P17948 3/20 0.50
FGFR1 P11362 1/20 0.50
EPHB2 P29323 1/20 0.50
FLT4 P35916 1/20 0.50
EGFR P00533 11/20 0.49
ABCG2 Q9UNQ0 1/20 0.48
RAF1 P04049 2/20 0.46
BRAF P15056 2/20 0.46
RET P07949 1/20 0.45
KIF5B P33176 1/20 0.45
SRC P12931 1/20 0.44

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
SCHEMBL22983424 1.00 KDR (0.50) KDRFLT1FGFR1EPHB2FLT4
SCHEMBL5097637 0.92 KDR (0.60) KDRFLT1FGFR1EPHB2FLT4
SCHEMBL4577834 0.91 SRC (0.56) KDRFLT1FGFR1EPHB2FLT4
SCHEMBL22983867 0.90 KDR (0.47) KDRFLT1FGFR1EPHB2FLT4
SCHEMBL29719135 0.90 RAF1 (0.51) KDRFLT1FGFR1EPHB2FLT4
SCHEMBL22983725 0.90 RAF1 (0.51) KDRFLT1FGFR1EPHB2FLT4
SCHEMBL29718942 0.90 KDR (0.47) KDRFLT1FGFR1EPHB2FLT4
SCHEMBL4579884 0.87 KDR (0.50) KDRFLT1FGFR1EPHB2FLT4
SCHEMBL3239502 0.87 EGFR (0.59) KDRFLT1FGFR1EPHB2FLT4
SCHEMBL157980 0.86 EGFR (0.50) KDRFLT1FGFR1EPHB2FLT4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-122079960-A Alkynyl quinazoline compounds 2026-05-26 CN disclosed
CN-119390683-A Alkynyl quinazoline compounds 黑钻治疗公司 2025-02-07 CN disclosed