SCHEMBL14923716

SCHEMBL14923716

CCOCCOCCNc1cccc2cc(Nc3nc(NC4CCCCC4N)c(F)cc3C(N)=O)cnc12

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ SYK P43405 15/20 0.46
▸ FER P16591 5/20 0.46
▸ MAPK3 P27361 2/20 0.44
▸ MAPK1 P28482 2/20 0.44
▸ KCNH2 Q12809 2/20 0.44
▸ AURKB Q96GD4 2/20 0.44
▸ GP6 Q9HCN6 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
SCHEMBL14929328 1.00 SYK (0.46) SYKFERMAPK3MAPK1KCNH2
SCHEMBL14923756 0.92 SYK (0.48) SYKFERMAPK3MAPK1KCNH2
SCHEMBL14931149 0.92 SYK (0.48) SYKFERMAPK3MAPK1KCNH2
SCHEMBL14929307 0.91 FER (0.49) SYKFERMAPK3MAPK1KCNH2
SCHEMBL14929503 0.87 SYK (0.52) SYKFERMAPK3MAPK1KCNH2
SCHEMBL14908739 0.86 FER (0.53) SYKFERMAPK3MAPK1KCNH2
SCHEMBL14908737 0.86 FER (0.53) SYKFERMAPK3MAPK1KCNH2
SCHEMBL14909853 0.85 FER (0.49) SYKFERMAPK3MAPK1KCNH2
SCHEMBL14929954 0.85 FER (0.49) SYKFERMAPK3MAPK1KCNH2
SCHEMBL14923887 0.85 FER (0.49) SYKFERMAPK3MAPK1KCNH2

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
EP-2589592-A1 NOVEL NICOTINAMIDE DERIVATIVES OR SALTS THEREOF FUJIFILM Corporation (JP) 2013-05-08 — — EP disclosed
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