SCHEMBL2719026

SCHEMBL2719026

CC(=O)N1CCN(c2ccc(Nc3nc(Nc4ccc(N5CCN(C(C)=O)CC5)cc4)c(C(N)=O)c(=O)[nH]3)cc2)CC1

nearest known ligand 0.57

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ SYK P43405 18/20 0.57
▸ ALK Q9UM73 1/20 0.52
▸ MEN1 O00255 1/20 0.47
▸ MAPT P10636 1/20 0.47
▸ KMT2A Q03164 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
SCHEMBL2728249 0.94 SYK (0.53) SYKALK
SCHEMBL2716442 0.91 SYK (0.60) SYK
SCHEMBL2729750 0.90 SYK (0.61) SYK
SCHEMBL10272211 0.87 SYK (0.49) SYKALKMEN1MAPTKMT2A
SCHEMBL10272209 0.74 CDK7 (0.44) SYKALKMEN1MAPTKMT2A
SCHEMBL10271845 0.73 SYK (0.41) SYKMEN1MAPTKMT2A
SCHEMBL736081 0.72 SYK (1.00) SYK
SCHEMBL2717457 0.71 SYK (0.72) SYKALK
SCHEMBL2718800 0.69 SYK (0.69) SYKALK
SCHEMBL2716069 0.69 SYK (0.56) SYKALK

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 3 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
WO-2012061415-A1 OXYPYRIMIDINES AS SYK MODULATORS PORTOLA PHARMACEUTICALS, INC. (US) 2012-05-10 — — WO disclosed
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