SCHEMBL1447640

SCHEMBL1447640

CC(C)n1c(-c2ccnc(Nc3ccc(C(=O)N4CCN(C)CC4)cc3)n2)cnc1C1CC1

nearest known ligand 0.78

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CDK2 P24941 17/20 0.78
CDK1 P06493 8/20 0.78
KCNH2 Q12809 3/20 0.56
SYK P43405 1/20 0.49
IGF1R P08069 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
SCHEMBL1447679 0.97 CDK2 (0.73) CDK2CDK1KCNH2SYK
SCHEMBL1448230 0.88 CDK2 (1.00) CDK2CDK1KCNH2
SCHEMBL1447208 0.87 CDK2 (0.63) CDK2CDK1SYKIGF1R
SCHEMBL1448421 0.86 CDK2 (0.69) CDK2CDK1KCNH2
SCHEMBL1447907 0.86 CDK2 (0.69) CDK2CDK1KCNH2
SCHEMBL1447905 0.86 CDK2 (0.69) CDK2CDK1KCNH2
SCHEMBL1447698 0.84 CDK2 (0.93) CDK2CDK1KCNH2
SCHEMBL1447218 0.84 CDK2 (0.84) CDK2CDK1KCNH2
SCHEMBL1449343 0.84 CDK2 (0.77) CDK2CDK1KCNH2SYK
SCHEMBL1447267 0.83 CDK2 (0.84) CDK2CDK1KCNH2

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
EP-2301928-A1 Imidazolyl-pyrimidine compounds for use in the treatment of proliferative disorders AstraZeneca AB (SE) 2011-03-30 EP disclosed