SCHEMBL9520439

SCHEMBL9520439

Cc1oc(-c2ccccc2)nc1CCC(=O)c1ccc(CC2SC(=O)NC2=O)s1

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PPARG P37231 16/20 0.43
PPARA Q07869 13/20 0.43
KDM4E B2RXH2 1/20 0.43
CYP3A4 P08684 1/20 0.40
CYP2C9 P11712 1/20 0.40
KCNH2 Q12809 1/20 0.40
FFAR1 O14842 2/20 0.40
PPARD Q03181 1/20 0.39
HPGD P15428 1/20 0.39

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
SCHEMBL9523616 0.84 FFAR1 (0.42) PPARGPPARAFFAR1
SCHEMBL4185581 0.84 PPARG (0.44) PPARGPPARAKDM4ECYP3A4CYP2C9
Darglitazone SCHEMBL9436449 0.84 PPARG (0.48) PPARGPPARAKDM4ECYP3A4CYP2C9
Darglitazone SCHEMBL20125582 0.84 PPARG (0.48) PPARGPPARAKDM4ECYP3A4CYP2C9
Darglitazone SCHEMBL37497 0.84 PPARG (0.48) PPARGPPARAKDM4ECYP3A4CYP2C9
Darglitazone SCHEMBL674635 0.84 PPARG (0.48) PPARGPPARAKDM4ECYP3A4CYP2C9
SCHEMBL7719068 0.81 PPARG (0.43) PPARGPPARAKDM4ECYP3A4CYP2C9
SCHEMBL13451557 0.79 PPARG (0.48) PPARGPPARAPPARD
SCHEMBL9721218 0.78 PPARG (0.55) PPARGPPARA
Darglitazone SCHEMBL16554324 0.78 PPARG (0.44) PPARGPPARACYP3A4CYP2C9KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0332332-B1 HYPOGLYCEMIC THIAZOLIDINEDIONE DERIVATIVES PFIZER INC. (US) 1993-03-31 EP disclosed
US-5130379-A Anticholesterol agents and antidiabetic agents PFIZER INC. (US) 1992-07-14 US disclosed
US-5036079-A Anticholesterol PFIZER INC. (US) 1991-07-30 US disclosed
WO-1991003474-A1 HYPOGLYCEMIC THIAZOLIDINEDIONE DERIVATIVES PFIZER INC. (US) 1991-03-21 WO disclosed
EP-0332332-A1 Hypoglycemic thiazolidinedione derivatives PFIZER INC. (US) 1989-09-13 EP disclosed