SCHEMBL5973409

SCHEMBL5973409

CCCc1c(OCCc2cc3cc(CC(=O)O)ccc3n2C)ccc2c(CC(C)(C)C)noc12

nearest known ligand 0.58

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 18/20 0.58
NR1H2 P55055 16/20 0.58
NR1H3 Q13133 16/20 0.58
PPARA Q07869 16/20 0.58
PPARG P37231 13/20 0.58

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
SCHEMBL5973747 0.85 PPARD (0.66) PPARDNR1H2NR1H3PPARAPPARG
SCHEMBL5973350 0.83 PPARD (0.53) PPARDNR1H2NR1H3PPARAPPARG
SCHEMBL5973183 0.83 PPARD (0.53) PPARDNR1H2NR1H3PPARAPPARG
SCHEMBL5972939 0.82 PPARD (0.52) PPARDNR1H2NR1H3PPARAPPARG
SCHEMBL6925941 0.82 PPARD (0.54) PPARDNR1H2NR1H3PPARAPPARG
SCHEMBL7038876 0.81 PPARD (0.60) PPARDNR1H2NR1H3PPARAPPARG
SCHEMBL7042207 0.81 PPARD (0.60) PPARDNR1H2NR1H3PPARAPPARG
SCHEMBL6928324 0.81 PPARD (0.52) PPARDNR1H2NR1H3PPARAPPARG
SCHEMBL7473597 0.80 PPARD (0.73) PPARDNR1H2NR1H3PPARAPPARG
SCHEMBL7044588 0.79 PPARG (0.73) PPARDNR1H2NR1H3PPARAPPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0948327-B1 ANTIDIABETIC AGENTS MERCK & CO INC (US) 2006-03-08 EP claimed
EP-0948327-A4 ANTIDIABETIC AGENTS MERCK & CO INC (US) 2003-04-02 EP claimed
US-6160000-A Antidiabetic agents based on aryl and heteroarylacetic acids MERCK & CO., INC. (US) 2000-12-12 US claimed
EP-0948327-A1 ANTIDIABETIC AGENTS Merck & Co., Inc. (US) 1999-10-13 EP claimed
WO-1998027974-A1 ANTIDIABETIC AGENTS MERCK & CO., INC. (US) 1998-07-02 WO claimed
EP-0948327-B1 ANTIDIABETIC AGENTS MERCK & CO INC (US) 2006-03-08 EP disclosed
EP-0948327-A4 ANTIDIABETIC AGENTS MERCK & CO INC (US) 2003-04-02 EP disclosed
US-6515015-B1 In combination with one or more known sulfonylureas, biguanides, alpha -glucosidase inhibitors, other insulin secretogogues or insulin MERCK & CO. INC. 2003-02-04 US disclosed
US-6160000-A Antidiabetic agents based on aryl and heteroarylacetic acids MERCK & CO., INC. (US) 2000-12-12 US disclosed
US-6090839-A REDUCING TRIGLYCERIDE CONCENTRATION MERCK & CO., INC. (US) 2000-07-18 US disclosed
EP-0948327-A1 ANTIDIABETIC AGENTS Merck & Co., Inc. (US) 1999-10-13 EP disclosed
WO-1998027974-A1 ANTIDIABETIC AGENTS MERCK & CO., INC. (US) 1998-07-02 WO disclosed