SCHEMBL2492877

SCHEMBL2492877

CC(C)(C)OC(=O)N1CCN(c2ccc(Nc3ncc(C(N)=O)c(NCc4ccccc4)n3)cc2)CC1

nearest known ligand 0.79

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SYK P43405 8/20 0.79
STAT6 P42226 11/20 0.76
CCNK O75909 1/20 0.60
CCNA2 P20248 1/20 0.60
CDK2 P24941 1/20 0.60
CCND3 P30281 1/20 0.60
CDK9 P50750 1/20 0.60
CDK6 Q00534 1/20 0.60

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
SCHEMBL736067 0.88 SYK (1.00) SYKSTAT6
SCHEMBL2389021 0.87 STAT6 (0.77) SYKSTAT6
SCHEMBL2386576 0.84 STAT6 (1.00) SYKSTAT6
SCHEMBL736688 0.83 SYK (1.00) SYK
SCHEMBL2386837 0.83 STAT6 (1.00) SYKSTAT6
SCHEMBL2386908 0.81 STAT6 (0.85) SYKSTAT6
SCHEMBL23200452 0.81 CDK2 (0.80) SYKCCNKCCNA2CDK2CCND3
SCHEMBL2386532 0.81 STAT6 (0.77) SYKSTAT6
Hydrochloric Acid SCHEMBL2385626 0.80 STAT6 (0.80) SYKSTAT6
SCHEMBL15161255 0.80 SYK (0.84) SYKSTAT6

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-1518855-B1 DIAMINOPYRIMIDINECARBOXA MIDE DERIVATIVE ASTELLAS PHARMA INC (JP) 2011-10-26 EP disclosed
US-7449456-B2 Diaminopyrimidinecarboxamide derivative ASTELLAS PHARMA, INC. (JP) 2008-11-11 US disclosed