SCHEMBL18925552

SCHEMBL18925552

CNc1cccc(Nc2nc(NC3CCCC(F)(F)C3NC)c(F)cc2C(N)=O)c1C=N

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ SYK P43405 12/20 0.42
▸ FER P16591 8/20 0.38
▸ MAPK3 P27361 4/20 0.34
▸ MAPK1 P28482 4/20 0.34
▸ KCNH2 Q12809 4/20 0.34
▸ AURKB Q96GD4 4/20 0.34
▸ GP6 Q9HCN6 1/20 0.33

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
SCHEMBL20750862 1.00 SYK (0.42) SYKFERMAPK3MAPK1KCNH2
SCHEMBL18925689 0.95 SYK (0.42) SYKFERMAPK3MAPK1KCNH2
SCHEMBL18925549 0.91 SYK (0.49) SYKFER
SCHEMBL18925688 0.90 SYK (0.39) SYKFERMAPK3MAPK1KCNH2
SCHEMBL20750777 0.89 FER (0.42) SYKFER
SCHEMBL20750776 0.85 FER (0.51) SYKFERMAPK3MAPK1KCNH2
SCHEMBL18925557 0.85 SYK (0.43) SYKFERMAPK3MAPK1KCNH2
SCHEMBL20750725 0.84 SYK (0.52) SYKFER
SCHEMBL18925840 0.84 SYK (0.52) SYKFER
SCHEMBL20750840 0.82 SYK (0.53) 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-3176154-A1 BENZAMIDES AND NICOTINAMIDES AS SYK MODULATORS Portola Pharmaceuticals, Inc. (US) 2017-06-07 — — EP disclosed
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