SCHEMBL1964840

SCHEMBL1964840

Cc1cc(-n2c(Nc3c(Cl)cccc3Cl)nc3cc(C(=O)O)ccc32)c(Cl)cc1C(N)=O

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LCK P06239 4/20 0.47
HSD17B10 Q99714 2/20 0.43
THRB P10828 1/20 0.41
HTT P42858 1/20 0.40
RXRA P19793 3/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
RORC P51449 3/20 0.40
CSNK2A2 P19784 1/20 0.38
CSNK2B P67870 1/20 0.38
CSNK2A1 P68400 1/20 0.38
HSP90AA1 P07900 1/20 0.38
HSP90AB1 P08238 1/20 0.38
PIK3CD O00329 1/20 0.37
PIK3CA P42336 1/20 0.37
PIK3CB P42338 1/20 0.37
MTOR P42345 1/20 0.37
PIK3CG P48736 1/20 0.37
RARG P13631 1/20 0.37

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
SCHEMBL1966409 0.92 LCK (0.42) LCKHSD17B10THRBHTTRXRA
SCHEMBL1973510 0.87 HSD17B10 (0.44) LCKHSD17B10THRBHTTRXRA
SCHEMBL1970564 0.83 LCK (0.41) LCKHSD17B10THRBHTTSMN1; SMN2
SCHEMBL1965510 0.82 HSD17B10 (0.42) LCKHSD17B10THRBHTTSMN1; SMN2
SCHEMBL1967011 0.82 LCK (0.45) LCKHSD17B10THRBHTTRXRA
SCHEMBL1964624 0.82 LCK (0.45) LCKHSD17B10THRBRORCCSNK2A2
SCHEMBL1967727 0.82 LCK (0.56) LCKHSD17B10THRBHTTSMN1; SMN2
SCHEMBL1964805 0.81 KIF11 (0.41) LCKHSD17B10RXRARORCCSNK2A2
SCHEMBL1967636 0.81 LCK (0.46) LCKHSD17B10THRBHTTSMN1; SMN2
SCHEMBL1967758 0.80 LCK (0.45) LCKHSD17B10THRBHTTSMN1; SMN2

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