SCHEMBL27713320

SCHEMBL27713320

O=C(O)CCCc1cc2cc(C(F)(F)F)ccc2n1S(=O)(=O)CC=Cc1ccc2c(c1)OCO2

nearest known ligand 0.54

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 18/20 0.54
▸ PPARA Q07869 15/20 0.54
▸ PPARD Q03181 12/20 0.52
▸ S1PR5 Q9H228 2/20 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
SCHEMBL28775104 0.88 PPARG (0.52) PPARGPPARAPPARDS1PR5
SCHEMBL27713325 0.88 PPARG (0.68) PPARGPPARAPPARD
SCHEMBL27733822 0.83 PPARG (0.45) PPARGPPARAPPARD
SCHEMBL27713773 0.83 PPARG (0.53) PPARGPPARAPPARDS1PR5
SCHEMBL27713307 0.82 PPARG (0.60) PPARGPPARAPPARD
SCHEMBL3523518 0.82 PPARG (0.75) PPARGPPARAPPARD
SCHEMBL28806426 0.82 PPARG (0.58) PPARGPPARAPPARD
SCHEMBL27713590 0.81 PPARG (0.51) PPARGPPARAPPARD
SCHEMBL27833812 0.81 PPARG (0.56) PPARGPPARAPPARD
SCHEMBL28775096 0.80 PPARG (0.64) 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
CN-101248044-B Indole compounds FOURNIER LAB SA 2012-05-30 — — CN disclosed
CN-101248044-A Novel indole compounds FOURNIER LAB SA (FR) 2008-08-20 — — CN disclosed
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