SCHEMBL14280362

SCHEMBL14280362

CCCc1cc(Oc2ccccc2)ccc1OCCCCOc1cccc(S(=O)(=O)NC(=O)NC2CCCCC2)c1

nearest known ligand 0.56

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 16/20 0.56
▸ PPARA Q07869 9/20 0.56
▸ PPARD Q03181 2/20 0.55
▸ HRH3 Q9Y5N1 3/20 0.48

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
SCHEMBL4871188 0.98 PPARD (0.57) PPARGPPARAPPARDHRH3
SCHEMBL4873102 0.93 PPARG (0.52) PPARGPPARAPPARDHRH3
SCHEMBL4872350 0.92 PPARG (0.55) PPARGPPARAPPARDHRH3
SCHEMBL4866992 0.85 HRH3 (0.54) PPARGPPARAPPARDHRH3
SCHEMBL4873144 0.85 PPARG (0.54) PPARGPPARAPPARDHRH3
SCHEMBL4866928 0.80 PPARA (0.51) PPARGPPARAPPARDHRH3
SCHEMBL4863686 0.78 HRH3 (0.69) PPARGHRH3
SCHEMBL4870642 0.75 PPARD (0.58) PPARGPPARAPPARD
SCHEMBL2521542 0.72 PPARG (0.57) PPARGPPARAPPARD
SCHEMBL2521544 0.72 PPARG (0.57) PPARGPPARAPPARD

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
US-7319170-B2 N-cyclohexylaminocarbonyl benzensulfonmide derivatives MERCK & CO., INC. (US) 2008-01-15 — — US disclosed
US-7319170-B2 N-cyclohexylaminocarbonyl benzensulfonmide derivatives MERCK & CO., INC. (US) 2008-01-15 — — US disclosed
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