SCHEMBL1965510

SCHEMBL1965510

NC(=O)c1ccc(-n2c(Nc3c(Cl)cccc3Cl)nc3cc(C(=O)O)ccc32)cc1Cl

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.42
THRB P10828 1/20 0.42
LCK P06239 1/20 0.42
RORC P51449 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
HTT P42858 1/20 0.39
CSNK2A2 P19784 2/20 0.39
CSNK2B P67870 2/20 0.39
CSNK2A1 P68400 2/20 0.39
F9 P00740 3/20 0.37
PLA2G10 O15496 1/20 0.37
KMT2A Q03164 2/20 0.37
MEN1 O00255 1/20 0.37
HPGD P15428 2/20 0.36
MYC P01106 1/20 0.36
NR4A1 P22736 1/20 0.36
EHMT2 Q96KQ7 1/20 0.35
EHMT1 Q9H9B1 1/20 0.35

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
SCHEMBL1964379 0.89 KIF11 (0.40) HSD17B10THRBLCKRORCSMN1; SMN2
SCHEMBL1966409 0.86 LCK (0.42) HSD17B10THRBLCKRORCSMN1; SMN2
SCHEMBL1973510 0.85 HSD17B10 (0.44) HSD17B10THRBLCKRORCSMN1; SMN2
SCHEMBL1967727 0.83 LCK (0.56) HSD17B10THRBLCKRORCSMN1; SMN2
SCHEMBL1970564 0.83 LCK (0.41) HSD17B10THRBLCKRORCSMN1; SMN2
SCHEMBL1967636 0.82 LCK (0.46) HSD17B10THRBLCKRORCSMN1; SMN2
SCHEMBL1964840 0.82 LCK (0.47) HSD17B10THRBLCKRORCSMN1; SMN2
SCHEMBL1964805 0.81 KIF11 (0.41) HSD17B10LCKRORCCSNK2A2CSNK2B
SCHEMBL1965823 0.80 LCK (0.42) HSD17B10THRBLCKRORCSMN1; SMN2
SCHEMBL2361755 0.80 HSD17B10 (0.43) HSD17B10THRBRORCSMN1; SMN2HTT

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