SCHEMBL8304716

SCHEMBL8304716

O=C1SC(Cc2ccc(OCCON=Cc3ccc4ccccc4n3)cc2)C(=O)N1C(c1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PPARG P37231 11/20 0.34
FFAR1 O14842 9/20 0.34
PPARA Q07869 4/20 0.34
RARG P13631 1/20 0.33
RXRA P19793 1/20 0.33
CYSLTR2 Q9NS75 1/20 0.33
CYSLTR1 Q9Y271 1/20 0.33
ALOX5 P09917 1/20 0.31

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
SCHEMBL8304714 1.00 PPARG (0.34) PPARGFFAR1PPARARARGRXRA
SCHEMBL8307959 0.88 PPARG (0.38) PPARGFFAR1RARGRXRA
SCHEMBL8307958 0.88 PPARG (0.38) PPARGFFAR1RARGRXRA
SCHEMBL8305266 0.86 PPARG (0.35) PPARGFFAR1PPARARARGRXRA
SCHEMBL8305268 0.86 PPARG (0.35) PPARGFFAR1PPARARARGRXRA
SCHEMBL8306097 0.86 PPARG (0.35) PPARGFFAR1PPARARARGRXRA
SCHEMBL8306092 0.86 PPARG (0.35) PPARGFFAR1PPARARARGRXRA
SCHEMBL8308949 0.85 PPARG (0.38) PPARGFFAR1RARGRXRA
SCHEMBL8308951 0.85 PPARG (0.38) PPARGFFAR1RARGRXRA
SCHEMBL8307312 0.83 PPARG (0.36) PPARGFFAR1RARGRXRA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5972959-A Oxime derivatives, their preparation and their therapeutic use SANKYO COMPANY, LIMITED (JP) 1999-10-26 US disclosed
EP-0708098-B1 Oxime derivatives, their preparation and their therapeutic use SANKYO CO (JP) 1999-03-03 EP disclosed
EP-0708098-A1 Oxime derivatives, their preparation and their therapeutic use SANKYO COMPANY LIMITED (JP) 1996-04-24 EP disclosed