SCHEMBL1447493

SCHEMBL1447493

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

nearest known ligand 0.57

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ CDK2 P24941 10/20 0.57
▸ CDK1 P06493 5/20 0.57
▸ KCNH2 Q12809 3/20 0.55
▸ CDK4 P11802 2/20 0.54
▸ CDKL1 Q00532 1/20 0.54
▸ SYK P43405 7/20 0.48
▸ ABL1 P00519 1/20 0.45
▸ BCR P11274 1/20 0.45

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
SCHEMBL1448311 0.92 CDK2 (0.62) CDK2CDK1KCNH2CDK4CDKL1
SCHEMBL1448361 0.89 CDK2 (0.55) CDK2CDK1CDK4SYK
SCHEMBL1447609 0.87 CDK2 (0.75) CDK2CDK1KCNH2CDK4CDKL1
SCHEMBL1447113 0.86 CDK2 (0.74) CDK2CDK1KCNH2CDK4
SCHEMBL1447633 0.85 CDK2 (0.59) CDK2CDK1KCNH2CDK4CDKL1
SCHEMBL1447917 0.84 CDK2 (0.71) CDK2CDK1KCNH2CDK4CDKL1
SCHEMBL3540056 0.81 CDK2 (0.61) CDK2CDK1KCNH2CDK4CDKL1
SCHEMBL1448282 0.80 CDK2 (0.59) CDK2CDK1KCNH2CDK4CDKL1
SCHEMBL1447533 0.79 CDK2 (0.82) CDK2CDK1KCNH2CDK4CDKL1
SCHEMBL34464867 0.78 CAMK2D (0.53) CDK2CDK1CDK4SYK

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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