SCHEMBL8304613

SCHEMBL8304613

O=C1SC(Cc2ccc(OCCO/N=C\c3cccc(-c4ccccc4)c3)cc2)C(=O)N1C(c1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 9/20 0.41
PPARG P37231 5/20 0.36
RARG P13631 1/20 0.32
RXRA P19793 1/20 0.32
PTPN1 P18031 1/20 0.32
ALDH1A1 P00352 1/20 0.32
UNG P13051 1/20 0.32
NPC1 O15118 1/20 0.32
POLB P06746 1/20 0.32
MAPK1 P28482 1/20 0.32
RAB9A P51151 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
CFTR P13569 1/20 0.31
ESR1 P03372 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
SCHEMBL8304616 1.00 FFAR1 (0.41) FFAR1PPARGRARGRXRAPTPN1
SCHEMBL8305071 0.92 PPARG (0.37) FFAR1PPARGRARGRXRAPTPN1
SCHEMBL8305072 0.92 PPARG (0.37) FFAR1PPARGRARGRXRAPTPN1
SCHEMBL8308949 0.92 PPARG (0.38) FFAR1PPARGRARGRXRAALDH1A1
SCHEMBL8308951 0.92 PPARG (0.38) FFAR1PPARGRARGRXRAALDH1A1
SCHEMBL8308869 0.90 PPARG (0.38) FFAR1PPARGRARGRXRAALDH1A1
SCHEMBL8308868 0.90 PPARG (0.38) FFAR1PPARGRARGRXRAALDH1A1
SCHEMBL8306097 0.89 PPARG (0.35) FFAR1PPARGRARGRXRAPTPN1
SCHEMBL8306092 0.89 PPARG (0.35) FFAR1PPARGRARGRXRAPTPN1
SCHEMBL8305971 0.87 PPARG (0.47) FFAR1PPARGRARGRXRAALDH1A1

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