SCHEMBL18925688

SCHEMBL18925688

CNc1cccc(Nc2nc(N[C@H]3[C@@H](N)CCCC3(F)F)c(F)cc2C(N)=O)c1C=N

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ SYK P43405 13/20 0.39
▸ FER P16591 6/20 0.37
▸ ROCK2 O75116 1/20 0.35
▸ ROCK1 Q13464 1/20 0.35
▸ MAPK3 P27361 2/20 0.34
▸ MAPK1 P28482 2/20 0.34
▸ KCNH2 Q12809 2/20 0.34
▸ AURKB Q96GD4 2/20 0.34

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
SCHEMBL18925689 0.91 SYK (0.42) SYKFERMAPK3MAPK1KCNH2
SCHEMBL20750862 0.90 SYK (0.42) SYKFERMAPK3MAPK1KCNH2
SCHEMBL18925552 0.90 SYK (0.42) SYKFERMAPK3MAPK1KCNH2
SCHEMBL18925549 0.89 SYK (0.49) SYKFER
SCHEMBL20750776 0.86 FER (0.51) SYKFERMAPK3MAPK1KCNH2
SCHEMBL20750777 0.82 FER (0.42) SYKFER
SCHEMBL9108879 0.80 SYK (0.53) SYK
SCHEMBL5027550 0.79 SYK (0.50) SYKFERMAPK3MAPK1KCNH2
SCHEMBL5028209 0.78 JAK2 (0.55) SYKFERROCK2ROCK1MAPK3
SCHEMBL18925871 0.78 SYK (0.43) SYKFERROCK2ROCK1MAPK3

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
EP-3176154-B1 BENZAMIDES AND NICOTINAMIDES AS SYK MODULATORS PORTOLA PHARM INC (US) 2019-02-20 — — EP disclosed
EP-3176154-A1 BENZAMIDES AND NICOTINAMIDES AS SYK MODULATORS Portola Pharmaceuticals, Inc. (US) 2017-06-07 — — EP disclosed
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