SCHEMBL16760403

SCHEMBL16760403

COc1cc2ncnc(Nc3ccc(F)c(O)c3F)c2cc1OC

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDR P35968 15/20 1.00
RET P07949 12/20 1.00
KIF5B P33176 11/20 1.00
FLT1 P17948 6/20 0.73
FGFR1 P11362 4/20 0.73
FLT4 P35916 2/20 0.73
EPHB2 P29323 1/20 0.73
RAF1 P04049 1/20 0.72
BRAF P15056 1/20 0.72
EGFR P00533 4/20 0.67
RIPK2 O43353 1/20 0.66
NOD1 Q9Y239 1/20 0.66
SRC P12931 1/20 0.65

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
Hydrochloric Acid SCHEMBL16760421 0.99 KDR (0.98) KDRRETKIF5BFLT1FGFR1
SCHEMBL21557366 0.91 KDR (0.83) KDRRETKIF5BFLT1FGFR1
SCHEMBL6669352 0.86 KDR (0.77) KDRRETKIF5BFLT1FGFR1
SCHEMBL18158611 0.84 KDR (0.82) KDRRETKIF5BFLT1FGFR1
SCHEMBL3012896 0.84 KDR (1.00) KDRRETKIF5BFLT1FGFR1
SCHEMBL7870603 0.84 KDR (1.00) KDRRETKIF5BFLT1FGFR1
SCHEMBL29365791 0.84 KDR (1.00) KDRRETKIF5BFLT1FGFR1
SCHEMBL15052315 0.84 RAF1 (1.00) KDRRETKIF5BRAF1BRAF
SCHEMBL16760370 0.83 RET (1.00) KDRRETKIF5BFLT1FGFR1
Hydrochloric Acid SCHEMBL7867640 0.83 KDR (0.98) KDRRETKIF5BFLT1FGFR1

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
WO-2015079251-A1 QUINAZOLINE COMPOUNDS CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2015-06-04 WO claimed
WO-2015079251-A1 QUINAZOLINE COMPOUNDS CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2015-06-04 WO disclosed