SCHEMBL6080907

SCHEMBL6080907

CN1C(=O)c2c(c3c4ccccc4[nH]c3c3cc[nH]c23)C1=O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKCA P17252 6/20 0.57
ROCK2 O75116 2/20 0.51
CDK4 P11802 9/20 0.51
CCND1 P24385 9/20 0.51
CCNE2 O96020 4/20 0.51
CCNE1 P24864 4/20 0.51
CDK2 P24941 4/20 0.51
NQO1 P15559 1/20 0.48
CDK5 Q00535 2/20 0.47
CDK5R1 Q15078 2/20 0.47
GSK3B P49841 2/20 0.47
GSK3A P49840 1/20 0.47
CCNB2 O95067 2/20 0.47
PRKCG P05129 2/20 0.47
PRKCB P05771 2/20 0.47
CDK1 P06493 2/20 0.47
CCNB1 P14635 2/20 0.47
CCNB3 Q8WWL7 2/20 0.47
MEN1 O00255 1/20 0.47
PRKD3 O94806 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
SCHEMBL5438544 0.85 PRKCA (0.71) PRKCAROCK2CDK4CCND1CCNE2
SCHEMBL14708732 0.80 ROCK2 (0.58) PRKCAROCK2CDK4CCND1CCNE2
SCHEMBL8122606 0.75 CDK4 (0.77) PRKCAROCK2CDK4CCND1CCNE2
SCHEMBL5440800 0.75 CDK4 (0.70) PRKCAROCK2CDK4CCND1CCNE2
SCHEMBL16504230 0.74 CDK4 (0.60) PRKCAROCK2CDK4CCND1NQO1
SCHEMBL14498911 0.74 ROCK2 (0.55) PRKCAROCK2CDK4CCND1CCNE2
SCHEMBL8317372 0.73 PRKCA (1.00) PRKCAROCK2CDK4CCND1CCNE2
SCHEMBL17682020 0.72 NQO1 (0.53) PRKCAROCK2CDK4CCND1CCNE2
SCHEMBL6080838 0.70 ROCK2 (0.48) PRKCAROCK2CDK4CCND1CCNE2
SCHEMBL5828670 0.70 PARP1 (0.59) PRKCAROCK2CDK4CCND1CCNE2

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
US-20060004428-A1 Pyrrolo (3,4-c) carbazole and pyrido (2,3-b) pyrrolo (3,4-e) indole derivatives, preparation method and pharmaceutical compositions containing same LES LABORATOIRES SERVIER (FR) 2006-01-05 US disclosed