SCHEMBL7815152

SCHEMBL7815152

COC(=O)C(Cc1ccc(OCCN(C)c2nc3ccccc3o2)cc1)OCC(F)(F)F

nearest known ligand 0.84

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PPARG P37231 20/20 0.84
PPARA Q07869 2/20 0.68

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
SCHEMBL7997939 1.00 PPARG (0.84) PPARGPPARA
SCHEMBL389036 0.92 PPARG (1.00) PPARGPPARA
SCHEMBL389037 0.92 PPARG (1.00) PPARGPPARA
SCHEMBL30475600 0.92 PPARG (1.00) PPARGPPARA
SCHEMBL8007402 0.91 PPARG (0.86) PPARGPPARA
SCHEMBL7824139 0.90 PPARG (0.83) PPARGPPARA
SCHEMBL7825955 0.89 PPARG (0.73) PPARGPPARA
SCHEMBL9270271 0.89 PPARG (0.76) PPARGPPARA
SCHEMBL7825493 0.89 PPARG (0.73) PPARGPPARA
SCHEMBL3106722 0.89 PPARG (0.84) 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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0648212-B1 BENZOXAZOLE AND BENZOTHIAZOLE DERIVATIVES AS PHARMACEUTICAL SMITHKLINE BEECHAM PLC (GB) 2001-10-24 EP claimed
EP-0648212-B1 BENZOXAZOLE AND BENZOTHIAZOLE DERIVATIVES AS PHARMACEUTICAL SMITHKLINE BEECHAM PLC (GB) 2001-10-24 EP disclosed
US-6166049-A Use of an antagonist of PPARα and PPARγ for the treatment of syndrome X SMITHKLINE BEECHAM P.L.C. (GB) 2000-12-26 US disclosed
EP-1000938-A1 Heterocyclic compounds as pharmaceuticals SMITHKLINE BEECHAM PLC (GB) 2000-05-17 EP disclosed
US-6048883-A HYPOGLYCEMIC AGENT SMITHKLINE BEECHAM P.L.C. (GB) 2000-04-11 US disclosed
EP-0879053-A1 USE OF AN ANTAGONIST OF PPAR-ALPHA AND PPAR-GAMMA FOR THE TREATMENT OF SYNDROM X SMITHKLINE BEECHAM PLC (GB) 1998-11-25 EP disclosed
WO-1997025042-A1 USE OF AN AGONIST OF PPAR-ALPHA AND PPAR-GAMMA FOR THE TREATMENT OF SYNDROM X SMITHKLINE BEECHAM P.L.C. (GB) 1997-07-17 WO disclosed
EP-0772605-A1 BENZOXAZOLES AND PYRIDINE DERIVATIVES USEFUL IN THE TREATMENT OF THE TYPE II DIABETES SMITHKLINE BEECHAM PLC (GB) 1997-05-14 EP disclosed
WO-1996004261-A1 BENZOXAZOLES AND PRYRIDINE DERIVATIVES USEFUL IN THE TREATMENT OF THE TYPE II DIABETES SMITHKLINE BEECHAM PLC (GB) 1996-02-15 WO disclosed
WO-1996004260-A1 BENZOXAZOLES AND PYRIDINE DERIVATIVES USEFUL IN THE TREATMENT OF THE TYPE II DIABETES SMITHKLINE BEECHAM PLC (GB) 1996-02-15 WO disclosed