SCHEMBL8975403

SCHEMBL8975403

O=C1NC(=O)C(Cc2ccc(OCCNCC(O)COc3cccc(-c4ccccc4)c3)cc2)S1

nearest known ligand 0.60

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 9/20 0.60
PPARG P37231 7/20 0.54
CYP1A2 P05177 1/20 0.51
ADRB2 P07550 1/20 0.51
ADRB1 P08588 1/20 0.51
ADRB3 P13945 1/20 0.51
ATM Q13315 1/20 0.49
PPARA Q07869 1/20 0.47
MPC2 O95563 1/20 0.47
CYP2C8 P10632 1/20 0.47
CYP2C9 P11712 1/20 0.47

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
SCHEMBL8975421 0.94 FFAR1 (0.57) FFAR1PPARGCYP1A2ADRB2ADRB1
SCHEMBL8975281 0.89 PPARG (0.54) FFAR1PPARGCYP1A2ADRB2ADRB1
SCHEMBL8974743 0.87 FFAR1 (0.59) FFAR1PPARGPPARAMPC2CYP2C8
SCHEMBL7173016 0.81 FFAR1 (0.58) FFAR1PPARGADRB2ADRB1ADRB3
SCHEMBL8974734 0.80 FFAR1 (0.56) FFAR1PPARGADRB2ADRB1ADRB3
SCHEMBL8974677 0.79 PPARG (0.57) FFAR1PPARGCYP1A2ADRB2ADRB1
SCHEMBL1072226 0.76 FFAR1 (0.77) FFAR1PPARGCYP1A2PPARAMPC2
SCHEMBL1746645 0.76 FFAR1 (1.00) FFAR1PPARGPPARAMPC2CYP2C8
SCHEMBL8974989 0.75 PPARG (0.56) FFAR1PPARGCYP1A2PPARAMPC2
SCHEMBL8315934 0.74 FFAR1 (0.64) FFAR1PPARGCYP1A2PPARAMPC2

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