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SCHEMBL18925841

SCHEMBL18925841

CN[C@@H]1C(Nc2nc(Nc3cc(F)cc(F)c3)c(C(N)=O)cc2F)CCCC1(F)F

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ SYK P43405 11/20 0.46
▸ FER P16591 8/20 0.42
▸ ZAP70 P43403 1/20 0.39
▸ ROCK2 O75116 1/20 0.37
▸ ROCK1 Q13464 1/20 0.37
▸ MAPK3 P27361 2/20 0.37
▸ MAPK1 P28482 2/20 0.37
▸ KCNH2 Q12809 2/20 0.37
▸ AURKB Q96GD4 2/20 0.37

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
SCHEMBL20750749 1.00 SYK (0.46) SYKFERZAP70ROCK2ROCK1
SCHEMBL18925611 0.95 SYK (0.47) SYKFERMAPK3MAPK1KCNH2
SCHEMBL18926202 0.92 SYK (0.42) SYKFERZAP70ROCK2ROCK1
SCHEMBL18925312 0.91 SYK (0.45) SYKFERMAPK3MAPK1KCNH2
SCHEMBL20750878 0.89 SYK (0.50) SYKFERZAP70MAPK3MAPK1
SCHEMBL9106548 0.88 SYK (0.54) SYKFERZAP70ROCK2ROCK1
SCHEMBL20750834 0.88 SYK (0.49) SYKFERMAPK3MAPK1KCNH2
SCHEMBL20750747 0.88 SYK (0.61) SYKFERMAPK3MAPK1KCNH2
SCHEMBL18925379 0.88 SYK (0.61) SYKFERMAPK3MAPK1KCNH2
SCHEMBL18925343 0.86 SYK (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-3176154-A1 BENZAMIDES AND NICOTINAMIDES AS SYK MODULATORS Portola Pharmaceuticals, Inc. (US) 2017-06-07 — — EP disclosed
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