SCHEMBL10271836

SCHEMBL10271836

CC(C)C[C@@H](Nc1nc(Nc2ccc(-n3cccn3)cc2)c(C(N)=O)c(=O)[nH]1)C(N)=O

nearest known ligand 0.64

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SYK P43405 18/20 0.64
CHEK2 O96017 1/20 0.39
LRRK2 Q5S007 1/20 0.38

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
SCHEMBL10272091 0.91 SYK (0.53) SYKCHEK2LRRK2
SCHEMBL10272204 0.91 SYK (0.66) SYKLRRK2
SCHEMBL2719001 0.89 SYK (0.50) SYK
SCHEMBL10271909 0.87 SYK (0.49) SYKCHEK2LRRK2
SCHEMBL2728953 0.85 SYK (0.53) SYK
SCHEMBL2728948 0.85 SYK (0.53) SYK
SCHEMBL2729996 0.84 SYK (0.58) SYKLRRK2
SCHEMBL10271847 0.84 SYK (0.58) SYKLRRK2
SCHEMBL2719516 0.83 SYK (0.50) SYK
SCHEMBL10272207 0.82 SYK (0.55) SYKLRRK2

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