SCHEMBL1448311

SCHEMBL1448311

CCn1c(-c2ccnc(Nc3ccc(C(=O)N4CCN(C)CC4)c(C)c3)n2)cnc1C

nearest known ligand 0.62

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CDK2 P24941 9/20 0.62
▸ CDK1 P06493 3/20 0.62
▸ NUAK1 O60285 1/20 0.50
▸ SYK P43405 7/20 0.49
▸ CDK4 P11802 2/20 0.49
▸ ABL1 P00519 1/20 0.48
▸ BCR P11274 1/20 0.48
▸ KCNH2 Q12809 3/20 0.48
▸ CDKL1 Q00532 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
SCHEMBL1447493 0.92 CDK2 (0.57) CDK2CDK1SYKCDK4ABL1
SCHEMBL1448361 0.90 CDK2 (0.55) CDK2CDK1SYKCDK4
SCHEMBL1447113 0.89 CDK2 (0.74) CDK2CDK1CDK4KCNH2
SCHEMBL1447533 0.87 CDK2 (0.82) CDK2CDK1CDK4KCNH2CDKL1
SCHEMBL1447537 0.85 CDK2 (0.61) CDK2CDK1NUAK1SYKCDK4
SCHEMBL1447825 0.84 CDK2 (0.77) CDK2CDK1CDK4KCNH2CDKL1
SCHEMBL3541350 0.81 CDK2 (0.62) CDK2CDK1NUAK1SYKCDK4
SCHEMBL1447799 0.80 CDK2 (0.66) CDK2CDK1SYKCDK4KCNH2
SCHEMBL1447162 0.80 CDK2 (0.69) CDK2CDK1CDK4KCNH2
SCHEMBL1447609 0.80 CDK2 (0.75) CDK2CDK1CDK4KCNH2CDKL1

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
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