SCHEMBL1965246

SCHEMBL1965246

NC(=O)c1ccc(-n2c(Nc3c(Cl)cccc3Cl)nc3cc(C(=O)O)cc(Br)c32)c(Cl)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LCK P06239 2/20 0.39
RORC P51449 3/20 0.38
PARP1 P09874 1/20 0.35
PARP2 Q9UGN5 1/20 0.35
CCNB2 O95067 2/20 0.34
CCNE2 O96020 2/20 0.34
CDK1 P06493 2/20 0.34
CDK4 P11802 2/20 0.34
CCNB1 P14635 2/20 0.34
CCND1 P24385 2/20 0.34
CCNE1 P24864 2/20 0.34
CDK2 P24941 2/20 0.34
CCNB3 Q8WWL7 2/20 0.34
PIK3CD O00329 1/20 0.33
PIK3CA P42336 1/20 0.33
PIK3CB P42338 1/20 0.33
MTOR P42345 1/20 0.33
PIK3CG P48736 1/20 0.33
CSNK2A2 P19784 4/20 0.32
CSNK2B P67870 3/20 0.32

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
SCHEMBL1967011 0.83 LCK (0.45) LCKRORCPIK3CDPIK3CAPIK3CB
SCHEMBL1967031 0.78 LCK (0.42) LCKRORCPARP1PARP2CCNB2
SCHEMBL16318357 0.78 LCK (0.43) LCKRORCHDAC6
SCHEMBL1964624 0.76 LCK (0.45) LCKRORCPIK3CDPIK3CAPIK3CB
SCHEMBL1967636 0.75 LCK (0.46) LCKRORCPIK3CDPIK3CAPIK3CB
SCHEMBL1965650 0.74 LCK (0.43) LCKRORCPIK3CDPIK3CAPIK3CB
SCHEMBL1968408 0.73 LCK (0.42) LCKRORCPARP1PARP2CCNB2
SCHEMBL1967758 0.73 LCK (0.45) LCKRORCPIK3CDPIK3CAPIK3CB
SCHEMBL1966409 0.73 LCK (0.42) LCKRORCPIK3CDPIK3CAPIK3CB
SCHEMBL1964840 0.71 LCK (0.47) LCKRORCPIK3CDPIK3CAPIK3CB

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
EP-2334652-A1 1H-BENZ IMIDAZOLE-5-CARBOXAMIDES AS ANTI-INFLAMMATORY AGENTS Boehringer Ingelheim International GmbH (DE) 2011-06-22 EP claimed
EP-2334652-A1 1H-BENZ IMIDAZOLE-5-CARBOXAMIDES AS ANTI-INFLAMMATORY AGENTS Boehringer Ingelheim International GmbH (DE) 2011-06-22 EP disclosed