SCHEMBL10367474

SCHEMBL10367474

COc1cc(C(=O)NS(=O)(=O)c2ccccc2)ccc1Cn1cc(Cl)c2ccc(NC(=O)CC3CCCC3)cc21

nearest known ligand 0.70

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CYSLTR1 Q9Y271 12/20 0.63
CYSLTR2 Q9NS75 11/20 0.63
EPHX2 P34913 2/20 0.56
PPARG P37231 2/20 0.56

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
SCHEMBL10370463 0.89 CYSLTR1 (0.55) CYSLTR1CYSLTR2EPHX2PPARG
SCHEMBL10368401 0.87 CYSLTR2 (0.69) CYSLTR1CYSLTR2
SCHEMBL9479001 0.86 CYSLTR1 (0.60) CYSLTR1CYSLTR2EPHX2PPARG
SCHEMBL9479233 0.86 CYSLTR2 (0.60) CYSLTR1CYSLTR2
SCHEMBL4452510 0.85 CYSLTR1 (0.57) CYSLTR1CYSLTR2EPHX2PPARG
SCHEMBL4468802 0.83 CYSLTR1 (0.82) CYSLTR1CYSLTR2EPHX2PPARG
SCHEMBL4461772 0.82 CYSLTR1 (0.61) CYSLTR1CYSLTR2EPHX2PPARG
SCHEMBL9481066 0.82 CYSLTR1 (0.80) CYSLTR1CYSLTR2EPHX2PPARG
Benzene SCHEMBL9478946 0.81 CYSLTR2 (0.53) CYSLTR1CYSLTR2
SCHEMBL9478845 0.80 CYSLTR1 (0.54) CYSLTR1CYSLTR2EPHX2PPARG

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-0179619-B1 HETEROCYCLIC AMIDES ICI AMERICAS INC. (US) 1990-09-05 EP claimed
EP-0179619-A1 Heterocyclic amides ICI AMERICAS INC. (US) 1986-04-30 EP claimed