SCHEMBL7873230

SCHEMBL7873230

O=C1NC(=O)C(c2c(CCCBr)[nH]c3ccccc23)=C1c1c(CCCBr)[nH]c2ccccc12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK4 P11802 10/20 0.42
CCND1 P24385 10/20 0.42
CCNE2 O96020 8/20 0.42
CCNE1 P24864 8/20 0.42
CDK2 P24941 8/20 0.42
CAMK2D Q13557 7/20 0.42
CCNB2 O95067 5/20 0.42
CDK1 P06493 5/20 0.42
CCNB1 P14635 5/20 0.42
CCNB3 Q8WWL7 5/20 0.42
CAMK2B Q13554 5/20 0.42
CAMK2G Q13555 5/20 0.42
CAMK2A Q9UQM7 5/20 0.42
PRKACA P17612 4/20 0.42
PRKACG P22612 4/20 0.42
PRKACB P22694 4/20 0.42
CDK5 Q00535 3/20 0.42
CDK5R1 Q15078 3/20 0.42
PRKD3 O94806 3/20 0.42
PRKCG P05129 3/20 0.42

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
SCHEMBL6865510 0.84 CDK4 (0.41) CDK4CCND1CCNE2CCNE1CDK2
SCHEMBL6867156 0.83 CDK4 (0.40) CDK4CCND1CCNE2CCNE1CDK2
SCHEMBL6860525 0.83 CDK4 (0.40) CDK4CCND1CCNE2CCNE1CDK2
SCHEMBL6867375 0.83 CDK4 (0.40) CDK4CCND1CCNE2CCNE1CDK2
SCHEMBL7785201 0.79 CAMK2D (0.61) CDK4CCND1CCNE2CCNE1CDK2
SCHEMBL6860161 0.78 CDK4 (0.40) CDK4CCND1CCNE2CCNE1CDK2
SCHEMBL5683201 0.77 CAMK2D (0.50) CDK4CCND1CCNE2CCNE1CDK2
SCHEMBL5686010 0.76 CAMK2D (0.50) CAMK2DPRKCBPRKCAPRKCHPRKCE
SCHEMBL5553378 0.76 GSK3B (0.48) CDK4CCND1CCNE2CCNE1CDK2
SCHEMBL7782574 0.76 CAMK2D (0.48) 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-0657458-B1 Protein kinase C inhibitors LILLY CO ELI (US) 2001-08-22 EP disclosed