SCHEMBL6080997

SCHEMBL6080997

O=C1NC(=O)c2c1c1c3ccccc3[nH]c1c1cccn21

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK4 P11802 10/20 0.61
CCND1 P24385 10/20 0.61
PRKCG P05129 6/20 0.61
PRKCB P05771 6/20 0.61
PRKCA P17252 6/20 0.61
CCNE2 O96020 6/20 0.61
CCNE1 P24864 6/20 0.61
CDK2 P24941 6/20 0.61
PRKD3 O94806 5/20 0.61
PRKCH P24723 5/20 0.61
PRKCI P41743 5/20 0.61
PRKCE Q02156 5/20 0.61
PRKCQ Q04759 5/20 0.61
PRKCZ Q05513 5/20 0.61
PRKCD Q05655 5/20 0.61
PRKD1 Q15139 5/20 0.61
CAMK2B Q13554 5/20 0.61
CAMK2G Q13555 5/20 0.61
CAMK2D Q13557 5/20 0.61
CAMK2A Q9UQM7 5/20 0.61

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
SCHEMBL6081058 0.85 CDK4 (0.50) CDK4CCND1PRKCGPRKCBPRKCA
SCHEMBL6080935 0.84 CDK4 (0.60) CDK4CCND1PRKCGPRKCBPRKCA
SCHEMBL6081478 0.84 ROCK2 (0.64) CDK4PRKCGPRKCBPRKCAPRKD3
SCHEMBL6080838 0.81 ROCK2 (0.48) CDK4CCND1PRKCGPRKCBPRKCA
SCHEMBL6080498 0.81 CDK4 (0.56) CDK4CCND1PRKCGPRKCBPRKCA
SCHEMBL6081708 0.78 CHEK1 (0.61) CDK4CCND1CCNE2CCNE1CDK2
Staurosporine Aglycon SCHEMBL29406635 0.77 CDK4 (1.00) CDK4CCND1PRKCGPRKCBPRKCA
Staurosporine Aglycon SCHEMBL8124103 0.77 CDK4 (1.00) CDK4CCND1PRKCGPRKCBPRKCA
Staurosporine Aglycon SCHEMBL30530825 0.77 CDK4 (1.00) CDK4CCND1PRKCGPRKCBPRKCA
SCHEMBL12270180 0.76 CHEK1 (0.46) CDK4CCND1PRKCGPRKCBPRKCA

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 2 patents. 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 claimed
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