SCHEMBL14396485

SCHEMBL14396485

CC(Cc1cccc(CO)c1)Nc1nccc(N(C)c2cc(-c3ccccc3)c3nc[nH]c3c2)n1

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ EPHB4 P54760 2/20 0.40
▸ KDR P35968 12/20 0.38
▸ FGFR1 P11362 1/20 0.38
▸ MAPK14 Q16539 3/20 0.34
▸ PARP1 P09874 1/20 0.32
▸ LRRK2 Q5S007 1/20 0.32

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
SCHEMBL3922932 0.85 KDR (0.39) EPHB4KDRFGFR1MAPK14
SCHEMBL5914429 0.81 EPHB4 (0.42) EPHB4KDRFGFR1MAPK14
SCHEMBL5314939 0.80 KDR (0.40) EPHB4KDRFGFR1MAPK14
SCHEMBL5317833 0.80 KDR (0.40) EPHB4KDRFGFR1MAPK14
SCHEMBL5266372 0.79 EPHB4 (0.44) EPHB4KDRFGFR1MAPK14
SCHEMBL5914084 0.78 KDR (0.37) EPHB4KDRFGFR1MAPK14
SCHEMBL5914097 0.78 KDR (0.37) EPHB4KDRFGFR1MAPK14
SCHEMBL5914022 0.78 KDR (0.37) EPHB4KDRFGFR1MAPK14
SCHEMBL3926763 0.78 DPP4 (0.36) EPHB4KDRFGFR1MAPK14
SCHEMBL3927419 0.77 KDR (0.33) EPHB4KDRFGFR1MAPK14

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-2007114827-A1 SUBSTITUTED HETEROCYCLIC COMPOUNDS AND METHODS OF USE AMGEN INC. (US) 2007-10-11 — — WO disclosed
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