SCHEMBL15211191

SCHEMBL15211191

Cc1nc(C(F)(F)F)sc1COc1ccc2c(CC(=O)O)csc2c1

nearest known ligand 0.75

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 20/20 0.75
PPARA Q07869 15/20 0.75
PPARG P37231 8/20 0.61
FFAR1 O14842 4/20 0.43

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
SCHEMBL17444888 0.91 PPARD (0.62) PPARDPPARAPPARGFFAR1
SCHEMBL17431307 0.87 PPARD (0.69) PPARDPPARAPPARGFFAR1
SCHEMBL5859765 0.86 PPARD (1.00) PPARDPPARAPPARGFFAR1
SCHEMBL15211802 0.85 PPARD (0.67) PPARDPPARAPPARG
SCHEMBL17431273 0.84 PPARD (0.66) PPARDPPARAPPARGFFAR1
SCHEMBL17431390 0.84 PPARD (0.66) PPARDPPARAPPARGFFAR1
SCHEMBL15211188 0.83 PPARD (0.53) PPARDPPARAPPARGFFAR1
SCHEMBL17431420 0.82 PPARD (0.53) PPARDPPARAPPARGFFAR1
SCHEMBL19191014 0.82 PPARD (0.63) PPARDPPARAPPARG
SCHEMBL15211347 0.82 PPARD (0.63) PPARDPPARAPPARG

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2838891-B1 AROMATIC RING COMPOUND AS GHRELIN O-ACYLTRANSFERASE INHIBITOR TAKEDA PHARMACEUTICALS CO (JP) 2017-08-02 EP disclosed
US-9238639-B2 Aromatic ring compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2016-01-19 US disclosed
US-9238639-B2 Aromatic ring compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2016-01-19 US disclosed
US-9238639-B2 Aromatic ring compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2016-01-19 US disclosed
EP-2838891-A1 AROMATIC RING COMPOUND Takeda Pharmaceutical Company Limited (JP) 2015-02-25 EP disclosed
WO-2013125732-A1 AROMATIC RING COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2013-08-29 WO disclosed