SCHEMBL1447162

SCHEMBL1447162

CCn1c(-c2ccnc(Nc3ccc(C(=O)N4CCOCC4)cc3)n2)cnc1C

nearest known ligand 0.69

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ CDK2 P24941 15/20 0.69
▸ CDK1 P06493 5/20 0.60
▸ BTK Q06187 1/20 0.53
▸ CDK4 P11802 2/20 0.53
▸ JAK2 O60674 1/20 0.52
▸ LRRK2 Q5S007 1/20 0.52
▸ PLK4 O00444 1/20 0.51
▸ KCNH2 Q12809 2/20 0.50
▸ MAPK10 P53779 1/20 0.49
▸ CCNT1 O60563 1/20 0.48
▸ CCNB1 P14635 1/20 0.48
▸ CCNA2 P20248 1/20 0.48
▸ CDK7 P50613 1/20 0.48
▸ CDK9 P50750 1/20 0.48
▸ CCNH P51946 1/20 0.48

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
SCHEMBL1447113 0.90 CDK2 (0.74) CDK2CDK1CDK4KCNH2
SCHEMBL1447567 0.90 CDK2 (0.72) CDK2CDK1BTKCDK4JAK2
SCHEMBL1447392 0.85 CDK2 (0.82) CDK2CDK1CDK4KCNH2CCNT1
SCHEMBL1447630 0.84 CDK2 (0.69) CDK2CDK1BTKJAK2LRRK2
SCHEMBL1447718 0.82 CDK2 (0.77) CDK2CDK1CDK4KCNH2CCNT1
SCHEMBL14021578 0.80 JAK2 (0.64) CDK2BTKJAK2LRRK2PLK4
SCHEMBL1448559 0.80 CDK2 (0.73) CDK2CDK1KCNH2
SCHEMBL1448311 0.80 CDK2 (0.62) CDK2CDK1CDK4KCNH2
SCHEMBL1447247 0.80 CDK2 (0.65) CDK2CDK1
SCHEMBL3939749 0.79 CDK2 (0.69) CDK2CDK1BTKLRRK2KCNH2

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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