SCHEMBL8975496

SCHEMBL8975496

O=C1NC(=O)C(Cc2ccc(OCCCN3CC(COc4ccccc4)OC3=O)cc2)S1

nearest known ligand 0.58

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.58
L3MBTL1 Q9Y468 1/20 0.58
HRH3 Q9Y5N1 1/20 0.56
FFAR1 O14842 12/20 0.52
PPARG P37231 6/20 0.51
PPARA Q07869 2/20 0.46
MEN1 O00255 1/20 0.46
ALDH1A1 P00352 1/20 0.46
TP53 P04637 1/20 0.46
CYP1A2 P05177 1/20 0.46
CYP3A4 P08684 1/20 0.46
MAPT P10636 1/20 0.46
HPGD P15428 1/20 0.46
ALOX15 P16050 1/20 0.46
TSHR P16473 1/20 0.46
KMT2A Q03164 1/20 0.46
HSD17B10 Q99714 1/20 0.46
TDP1 Q9NUW8 1/20 0.46

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
SCHEMBL8974565 0.88 FFAR1 (0.49) MAPK1L3MBTL1HRH3FFAR1PPARG
SCHEMBL8975030 0.86 FFAR1 (0.52) MAPK1L3MBTL1HRH3FFAR1PPARG
SCHEMBL8975009 0.82 FFAR1 (0.52) HRH3FFAR1PPARGPPARA
SCHEMBL8304663 0.81 HRH3 (0.56) HRH3FFAR1PPARGPPARAMEN1
SCHEMBL8974634 0.81 FFAR1 (0.49) HRH3FFAR1PPARGPPARAMEN1
SCHEMBL8857385 0.81 MAPK1 (0.52) MAPK1L3MBTL1HRH3
SCHEMBL9242566 0.79 PPARG (0.52) HRH3FFAR1PPARGPPARAMEN1
SCHEMBL1072226 0.78 FFAR1 (0.77) HRH3FFAR1PPARGPPARAMEN1
SCHEMBL9440663 0.78 HRH3 (0.55) HRH3FFAR1PPARGPPARAMEN1
SCHEMBL8941936 0.77 MAPT (0.56) HRH3FFAR1PPARGPPARAMEN1

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