SCHEMBL6438796

SCHEMBL6438796

CCC(Cc1ccc(OC(C)Cc2sc(-c3ccc(C(F)(F)F)cc3)nc2C)cc1C)C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 18/20 0.57
PPARA Q07869 15/20 0.57
PPARG P37231 6/20 0.57
FFAR1 O14842 4/20 0.49

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
SCHEMBL6473326 0.92 PPARD (0.54) PPARDPPARAPPARGFFAR1
SCHEMBL3372315 0.89 PPARD (0.72) PPARDPPARAPPARGFFAR1
SCHEMBL6439387 0.88 PPARD (0.55) PPARDPPARAPPARGFFAR1
SCHEMBL6439572 0.85 PPARD (0.53) PPARDPPARAPPARGFFAR1
SCHEMBL3372154 0.83 PPARD (0.53) PPARDPPARAPPARGFFAR1
SCHEMBL3370411 0.82 PPARD (0.48) PPARDPPARAPPARG
SCHEMBL3374163 0.81 PPARD (0.69) PPARDPPARAPPARGFFAR1
SCHEMBL3370487 0.80 PPARD (0.67) PPARDPPARAPPARGFFAR1
SCHEMBL3371253 0.77 PPARD (0.50) PPARDPPARAPPARG
SCHEMBL3369920 0.77 PPARD (0.70) PPARDPPARAPPARGFFAR1

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-1537091-A1 NOVEL 2-ARYLTHIAZOLE COMPOUNDS AS PPARALPHA AND PPARGAMMA AGONISTS F.HOFFMANN-LA ROCHE AG (CH) 2005-06-08 EP disclosed
WO-2004020420-A1 NOVEL 2-ARYLTHIAZOLE COMPOUNDS AS PPARALPHA AND PPARGAMA AGONISTS F.HOFFMANN-LA ROCHE AG (CH) 2004-03-11 WO disclosed