SCHEMBL1447876

SCHEMBL1447876

Cc1ncc(-c2ccnc(Nc3ccc(C(=O)N4CCN(C)CC4)cc3)n2)n1C1CCCC1

nearest known ligand 0.73

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CDK2 P24941 15/20 0.73
CDK1 P06493 7/20 0.72
KCNH2 Q12809 3/20 0.51
IKBKB O14920 3/20 0.48
CHUK O15111 3/20 0.48
IKBKG Q9Y6K9 3/20 0.48
MEN1 O00255 1/20 0.48
RECQL P46063 1/20 0.48
BLM P54132 1/20 0.48
KMT2A Q03164 1/20 0.48
PRKCZ Q05513 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
SYK P43405 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
SCHEMBL1447563 0.98 CDK2 (0.72) CDK2CDK1KCNH2IKBKBCHUK
SCHEMBL1447628 0.97 CDK2 (0.69) CDK2CDK1KCNH2IKBKBCHUK
SCHEMBL3939749 0.92 CDK2 (0.69) CDK2CDK1KCNH2SYK
SCHEMBL1447630 0.89 CDK2 (0.69) CDK2CDK1KCNH2IKBKBCHUK
SCHEMBL1448597 0.88 CDK2 (0.66) CDK2CDK1KCNH2SYK
SCHEMBL1447537 0.88 CDK2 (0.61) CDK2CDK1KCNH2SYK
SCHEMBL1447839 0.85 CDK2 (0.67) CDK2CDK1KCNH2IKBKBCHUK
SCHEMBL1447633 0.85 CDK2 (0.59) CDK2CDK1KCNH2SYK
SCHEMBL1447265 0.84 CDK2 (0.69) CDK2CDK1KCNH2SYK
SCHEMBL1447218 0.84 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