SCHEMBL3106722

SCHEMBL3106722

COC(=O)C(Cc1ccc(OCCN(C)c2nc3ccccc3o2)cc1)OC

nearest known ligand 0.84

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PPARG P37231 20/20 0.84
PPARA Q07869 2/20 0.73

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
SCHEMBL7815895 0.93 PPARG (0.81) PPARGPPARA
SCHEMBL7824139 0.92 PPARG (0.83) PPARGPPARA
SCHEMBL8061173 0.92 PPARG (0.74) PPARGPPARA
SCHEMBL7815781 0.91 PPARG (1.00) PPARGPPARA
SCHEMBL7825493 0.91 PPARG (0.73) PPARGPPARA
SCHEMBL9270271 0.91 PPARG (0.76) PPARGPPARA
SCHEMBL7825955 0.91 PPARG (0.73) PPARGPPARA
SCHEMBL9207919 0.91 PPARG (0.84) PPARGPPARA
SCHEMBL7909717 0.90 PPARG (0.80) PPARGPPARA
SCHEMBL7817262 0.90 PPARG (0.75) 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 14 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7803586-B2 Chemical Process ASTRAZENECA AB (SE) 2010-09-28 US disclosed
US-20080115247-A1 Chemical Process ASTRAZENECA AB (SE) 2008-05-15 US disclosed
EP-1828394-A2 CHEMICAL PROCESS AstraZeneca AB (SE) 2007-09-05 EP disclosed
WO-2006064213-A2 CHEMICAL PROCESS ASTRAZENECA AB (SE) 2006-06-22 WO disclosed
US-6743608-B2 GENERATION OF PREFERENTIAL ENANTIOMERS; OBTAIN SUBSTRATE, INCUBATE WITH ENZYME, RECOVER PRODUCT NOVO NORDISK PHARMACEUTICALS, INC. (DK) 2004-06-01 US disclosed
US-20030008361-A1 Process for the preparation of substituted 3-phenyl-propanoic acid esters and substituted 3-phenyl-propanoic acids EBDRUP SOREN (DK) 2003-01-09 US disclosed
EP-1206565-A1 PROCESS FOR THE PREPARATION OF SUBSTITUTED 3-PHENYL-PROPANOIC ACID ESTERS AND SUBSTITUTED 3-PHENYL-PROPANOIC ACIDS NOVO NORDISK A/S (DK) 2002-05-22 EP disclosed
EP-0648212-B1 BENZOXAZOLE AND BENZOTHIAZOLE DERIVATIVES AS PHARMACEUTICAL SMITHKLINE BEECHAM PLC (GB) 2001-10-24 EP disclosed
WO-2001011073-A1 PROCESS FOR THE PREPARATION OF SUBSTITUTED 3-PHENYL-PROPANOIC ACID ESTERS AND SUBSTITUTED 3-PHENYL-PROPANOIC ACIDS NOVO NORDISK A/S (DK) 2001-02-15 WO disclosed
WO-2001011072-A1 PROCESS FOR THE PREPARATION OF SUBSTITUTED 3-PHENYL-PROPANOIC ACID ESTERS AND SUBSTITUTED 3-PHENYL-PROPANOIC ACIDS NOVO NORDISK A/S (DK) 2001-02-15 WO 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-0648212-A1 HETEROCYCLIC COMPOUNDS AS PHARMACEUTICAL SMITHKLINE BEECHAM PLC (GB) 1995-04-19 EP disclosed
WO-1994001420-A1 HETEROCYCLIC COMPOUNDS AS PHARMACEUTICAL SMITHKLINE BEECHAM PLC (GB) 1994-01-20 WO disclosed