SCHEMBL27751699

SCHEMBL27751699

COCCOc1cc2c(Nc3ccc(F)c(Cl)c3)ccnc2cc1OC

nearest known ligand 0.73

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDR P35968 3/20 0.73
FGFR1 P11362 2/20 0.73
FLT1 P17948 2/20 0.73
EGFR P00533 18/20 0.65
AURKA O14965 1/20 0.58
ERBB2 P04626 1/20 0.58
INSR P06213 1/20 0.58
FBP1 P09467 1/20 0.58
PDGFRB P09619 1/20 0.58
FLT4 P35916 1/20 0.58
CLK1 P49759 1/20 0.58
EPHB4 P54760 1/20 0.58
TEK Q02763 1/20 0.58
AURKB Q96GD4 1/20 0.58
GAK O14976 1/20 0.57

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
SCHEMBL27751680 0.92 EGFR (0.70) KDRFGFR1FLT1EGFRAURKA
SCHEMBL31213837 0.89 EGFR (0.61) KDRFGFR1FLT1EGFRAURKA
SCHEMBL27865264 0.85 FGFR1 (0.70) KDRFGFR1FLT1EGFRFBP1
SCHEMBL6431198 0.84 FLT1 (1.00) KDRFGFR1FLT1EGFRERBB2
Hydrochloric Acid SCHEMBL6431524 0.84 FLT1 (0.98) KDRFGFR1FLT1EGFRERBB2
SCHEMBL27780668 0.83 KDR (0.54) KDRFGFR1FLT1EGFRGAK
SCHEMBL28778139 0.83 EGFR (0.60) KDRFGFR1FLT1EGFRAURKA
SCHEMBL12308286 0.83 EGFR (0.77) KDRFGFR1FLT1EGFRERBB2
SCHEMBL6432152 0.82 FLT1 (1.00) KDRFGFR1FLT1EGFRFLT4
Hydrochloric Acid SCHEMBL6431098 0.81 FLT1 (0.98) KDRFGFR1FLT1EGFRFLT4

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-101362719-B Chinolines derivates and composition containing thereof UNIV BEIJING NORMAL 2012-04-18 CN disclosed
CN-101362719-A Chinolines derivates and composition containing thereof UNIV BEIJING NORMAL (CN) 2009-02-11 CN disclosed