SCHEMBL8974731

SCHEMBL8974731

CC(COc1ccc(CC2SC(=O)NC2=O)cc1)NCC(O)CSc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 10/20 0.50
PPARG P37231 9/20 0.50
PPARA Q07869 4/20 0.47
MEN1 O00255 1/20 0.44
ALDH1A1 P00352 1/20 0.44
TP53 P04637 1/20 0.44
CYP1A2 P05177 1/20 0.44
CYP3A4 P08684 1/20 0.44
MAPT P10636 1/20 0.44
HPGD P15428 1/20 0.44
ALOX15 P16050 1/20 0.44
TSHR P16473 1/20 0.44
KMT2A Q03164 1/20 0.44
HSD17B10 Q99714 1/20 0.44
TDP1 Q9NUW8 1/20 0.44

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
SCHEMBL8974677 0.89 PPARG (0.57) FFAR1PPARGPPARAMEN1ALDH1A1
SCHEMBL8974649 0.87 FFAR1 (0.53) FFAR1PPARGPPARAMEN1ALDH1A1
SCHEMBL8974734 0.86 FFAR1 (0.56) FFAR1PPARGPPARA
SCHEMBL8975130 0.85 FFAR1 (0.52) FFAR1PPARGPPARA
SCHEMBL8975446 0.83 PPARG (0.50) FFAR1PPARGPPARA
SCHEMBL8974550 0.83 FFAR1 (0.52) FFAR1PPARGMEN1ALDH1A1CYP3A4
SCHEMBL8974743 0.82 FFAR1 (0.59) FFAR1PPARGPPARAMEN1ALDH1A1
SCHEMBL8975029 0.82 FFAR1 (0.50) FFAR1PPARGMEN1ALDH1A1CYP3A4
SCHEMBL8974598 0.81 FFAR1 (0.49) FFAR1PPARGMEN1ALDH1A1CYP3A4
SCHEMBL8974608 0.81 FFAR1 (0.54) FFAR1PPARGPPARA

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
US-5578620-A TREATMENT OF DIABETES AND HYPERLIPEMIA SANKYO COMPANY, LIMITED (JP) 1996-11-26 US disclosed
EP-0678511-A2 Thiazolidine and oxazolidine derivatives, their preparation and their medical use SANKYO COMPANY LIMITED (JP) 1995-10-25 EP disclosed