SCHEMBL2728249

SCHEMBL2728249

CC(=O)N1CCN(c2ccc(Nc3nc(Nc4cc(C)cc(C)c4)c(C(N)=O)c(=O)[nH]3)cc2)CC1

nearest known ligand 0.53

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ SYK P43405 19/20 0.53
▸ ALK Q9UM73 1/20 0.47

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
SCHEMBL2719026 0.94 SYK (0.57) SYKALK
SCHEMBL2716442 0.86 SYK (0.60) SYK
SCHEMBL2729750 0.84 SYK (0.61) SYK
SCHEMBL10272211 0.82 SYK (0.49) SYKALK
SCHEMBL2719063 0.75 SYK (0.58) SYK
SCHEMBL2717457 0.75 SYK (0.72) SYKALK
SCHEMBL2718800 0.73 SYK (0.69) SYKALK
SCHEMBL2729936 0.72 SYK (0.49) SYKALK
SCHEMBL2730052 0.71 SYK (0.47) SYK
SCHEMBL2716612 0.71 SYK (0.47) SYK

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
WO-2012061415-A1 OXYPYRIMIDINES AS SYK MODULATORS PORTOLA PHARMACEUTICALS, INC. (US) 2012-05-10 — — WO claimed
WO-2012061415-A1 OXYPYRIMIDINES AS SYK MODULATORS PORTOLA PHARMACEUTICALS, INC. (US) 2012-05-10 — — WO disclosed
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