SCHEMBL2729602

SCHEMBL2729602

COc1ccc(Nc2nc(N[C@H](CC(C)C)C(N)=O)[nH]c(=O)c2C(N)=O)cc1OC

nearest known ligand 0.44

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SYK P43405 19/20 0.44
MAPK8 P45983 1/20 0.40
MAPK9 P45984 1/20 0.40

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
SCHEMBL2729610 1.00 SYK (0.44) SYKMAPK8MAPK9
SCHEMBL2729181 0.89 SYK (0.47) SYK
SCHEMBL2729183 0.89 SYK (0.47) SYK
SCHEMBL2716675 0.87 SYK (0.51) SYK
SCHEMBL2716671 0.87 SYK (0.51) SYK
SCHEMBL10272220 0.85 SYK (0.43) SYK
SCHEMBL2728618 0.84 SYK (0.44) SYK
SCHEMBL2728622 0.84 SYK (0.44) SYK
SCHEMBL2728643 0.84 SYK (0.48) SYK
SCHEMBL2728647 0.84 SYK (0.48) 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 disclosed
WO-2012061415-A1 OXYPYRIMIDINES AS SYK MODULATORS PORTOLA PHARMACEUTICALS, INC. (US) 2012-05-10 WO disclosed