SCHEMBL7437467

SCHEMBL7437467

CCCCC1(CNc2nc(C)nc3c2c(SC)nn3-c2c(Cl)cc(Cl)cc2Cl)CC1

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CDK4 P11802 19/20 0.46
CCND1 P24385 19/20 0.46
CCNE2 O96020 10/20 0.45
CCNE1 P24864 10/20 0.45
CDK2 P24941 10/20 0.45
CCNB2 O95067 1/20 0.45
CDK1 P06493 1/20 0.45
CCNB1 P14635 1/20 0.45
CCNB3 Q8WWL7 1/20 0.45
CRHR1 P34998 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
SCHEMBL7446420 0.78 CDK4 (0.49) CDK4CCND1CCNE2CCNE1CDK2
SCHEMBL5707841 0.76 CDK4 (0.46) CDK4CCND1CCNE2CCNE1CDK2
SCHEMBL5600331 0.73 CDK4 (0.53) CDK4CCND1CCNE2CCNE1CDK2
SCHEMBL7965911 0.72 CRHR1 (0.63) CDK4CCND1CCNE2CCNE1CDK2
SCHEMBL8122461 0.72 CDK4 (0.51) CDK4CCND1CCNE2CCNE1CDK2
SCHEMBL5600433 0.72 CRHR1 (0.57) CDK4CCND1CCNE2CCNE1CDK2
SCHEMBL5599666 0.71 CDK4 (0.54) CDK4CCND1CCNE2CCNE1CDK2
SCHEMBL7953100 0.71 CDK4 (0.63) CDK4CCND1CCNE2CCNE1CDK2
SCHEMBL5611027 0.70 CDK4 (0.55) CDK4CCND1CCNE2CCNE1CDK2
SCHEMBL7044979 0.70 CDK4 (0.55) CDK4CCND1CCNE2CCNE1CDK2

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-1149583-A2 Combinations of corticotropin releasing factor antagonists and growth hormone secretagogues Pfizer Products Inc. (US) 2001-10-31 EP claimed