SCHEMBL2053741

SCHEMBL2053741

Cc1cc(Nc2nccc(C)n2)cc(-c2cnc(C(O)(CO)CO)[nH]2)c1

nearest known ligand 0.48

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ SYK P43405 20/20 0.48
▸ SRC P12931 3/20 0.42
▸ ZAP70 P43403 3/20 0.42
▸ CDK2 P24941 2/20 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
SCHEMBL16737487 0.78 SYK (0.52) SYKSRCZAP70CDK2
SCHEMBL2509056 0.78 SYK (0.63) SYKSRCZAP70
SCHEMBL16876267 0.71 SYK (0.48) SYK
SCHEMBL16876174 0.71 SYK (0.48) SYK
SCHEMBL16876381 0.71 SYK (0.48) SYK
SCHEMBL16876558 0.70 GRM8 (0.56) SYKSRCZAP70CDK2
SCHEMBL16885381 0.70 SYK (0.47) SYK
SCHEMBL2052608 0.69 SYK (0.58) SYK
SCHEMBL16737670 0.69 SYK (0.60) SYK
SCHEMBL16965340 0.69 SYK (0.46) SYKSRCZAP70CDK2

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
EP-2513098-A1 AMINOPYRIMIDINES AS SYK INHIBITORS Merck Sharp & Dohme Corp. (US) 2012-10-24 — — EP disclosed
WO-2011075515-A1 AMINOPYRIMIDINES AS SYK INHIBITORS MERCK SHARP & DOHME CORP. (US) 2011-06-23 — — WO disclosed
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