SCHEMBL9520637

SCHEMBL9520637

Cc1oc(-c2ccc(C(F)(F)F)cc2)nc1CCC(=O)c1ccc(CC2SC(=O)NC2=O)cc1

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PPARG P37231 12/20 0.49
PPARA Q07869 11/20 0.46
FFAR1 O14842 3/20 0.45
PPARD Q03181 3/20 0.39
CYP2C9 P11712 2/20 0.39
CYP3A4 P08684 1/20 0.39
KCNH2 Q12809 1/20 0.39
TP53 P04637 1/20 0.38
MAPT P10636 1/20 0.38

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
SCHEMBL9520353 0.90 PPARG (0.47) PPARGPPARAPPARDCYP2C9TP53
Darglitazone SCHEMBL20125582 0.89 PPARG (0.48) PPARGPPARAFFAR1PPARDCYP2C9
Darglitazone SCHEMBL37497 0.89 PPARG (0.48) PPARGPPARAFFAR1PPARDCYP2C9
Darglitazone SCHEMBL9436449 0.89 PPARG (0.48) PPARGPPARAFFAR1PPARDCYP2C9
Darglitazone SCHEMBL674635 0.88 PPARG (0.48) PPARGPPARAFFAR1PPARDCYP2C9
SCHEMBL9521756 0.85 PPARG (0.45) PPARGPPARAFFAR1CYP2C9CYP3A4
SCHEMBL9523122 0.82 PPARG (0.44) PPARGPPARAFFAR1CYP2C9CYP3A4
Darglitazone SCHEMBL16554324 0.82 PPARG (0.44) PPARGPPARAFFAR1PPARDCYP2C9
SCHEMBL8155423 0.79 PPARA (0.42) PPARGPPARAPPARDCYP2C9CYP3A4
SCHEMBL9521656 0.79 PIM1 (0.50) PPARGPPARA

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