SCHEMBL16743258

SCHEMBL16743258

NC(=O)c1nnc(N[C@@H]2CCCC[C@@H]2N)nc1Nc1cnc2ccc(F)cc2c1

nearest known ligand 0.71

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ SYK P43405 20/20 0.71
▸ KCNH2 Q12809 1/20 0.58
▸ AURKB Q96GD4 1/20 0.56

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
SCHEMBL16743283 0.93 SYK (0.68) SYKKCNH2AURKB
SCHEMBL14839136 0.89 SYK (0.79) SYKKCNH2AURKB
SCHEMBL14955508 0.86 LRRK2 (0.65) SYKKCNH2
SCHEMBL16743160 0.86 SYK (0.68) SYKKCNH2AURKB
SCHEMBL16743159 0.86 SYK (0.71) SYKKCNH2AURKB
SCHEMBL16743309 0.84 SYK (0.68) SYKKCNH2AURKB
SCHEMBL16743175 0.84 SYK (0.73) SYKKCNH2AURKB
SCHEMBL14839231 0.84 SYK (0.76) SYKKCNH2AURKB
SCHEMBL15910650 0.83 SYK (1.00) SYKKCNH2AURKB
SCHEMBL16743187 0.82 SYK (0.76) SYKKCNH2AURKB

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
US-9040530-B2 1,2,4-triazine-6-carboxamide kinase inhibitors PORTOLA PHARMACEUTICALS, INC. (US) 2015-05-26 — — US disclosed
US-9040530-B2 1,2,4-triazine-6-carboxamide kinase inhibitors PORTOLA PHARMACEUTICALS, INC. (US) 2015-05-26 — — US disclosed
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