SCHEMBL9520604

SCHEMBL9520604

Cc1oc(-c2ccccc2)nc1CCC(=O)c1ccc(Br)s1

nearest known ligand 0.53

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.53
PPARG P37231 16/20 0.49
PPARA Q07869 14/20 0.49
HPGD P15428 1/20 0.47
FFAR1 O14842 1/20 0.47
PPARD Q03181 1/20 0.47
HRH3 Q9Y5N1 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
SCHEMBL9721259 0.91 PPARG (0.45) KDM4EPPARGPPARAHPGDPPARD
SCHEMBL27256704 0.83 KDM4E (0.49) KDM4EPPARGPPARAHPGDPPARD
SCHEMBL9008052 0.80 KDM4E (0.56) KDM4EPPARGPPARAHPGDFFAR1
SCHEMBL7879558 0.80 KDM4E (0.56) KDM4EPPARGPPARAHPGDFFAR1
SCHEMBL4034559 0.79 KDM4E (0.73) KDM4EPPARGPPARAHPGDFFAR1
SCHEMBL14373654 0.77 KDM4E (0.59) KDM4EPPARGPPARAHPGDFFAR1
SCHEMBL5123862 0.77 PPARA (0.63) PPARGPPARAPPARD
SCHEMBL14265738 0.77 PPARA (0.63) PPARGPPARAPPARD
SCHEMBL9520439 0.77 PPARG (0.43) KDM4EPPARGPPARAHPGDFFAR1
SCHEMBL4031089 0.76 KDM4E (0.65) KDM4EPPARGPPARAHPGDFFAR1

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 7 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
CN-1036572-A Thiazolidinedione derivatives for lowering blood glucose PFIZER (US) 1989-10-25 CN disclosed
WO-1989008651-A1 HYPOGLYCEMIC THIAZOLIDINEDIONE DERIVATIVES PFIZER INC. (US) 1989-09-21 WO disclosed
EP-0332332-A1 Hypoglycemic thiazolidinedione derivatives PFIZER INC. (US) 1989-09-13 EP disclosed