SCHEMBL6927906

SCHEMBL6927906

CCCc1c(OCCc2ccc3cc(CC(=O)O)ccc3n2)ccc2c(CC(C)(C)C)coc12

nearest known ligand 0.53

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 16/20 0.53
PPARA Q07869 14/20 0.53
PPARG P37231 11/20 0.53
NR1H3 Q13133 16/20 0.45
NR1H2 P55055 14/20 0.45

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
SCHEMBL6926401 0.88 PPARD (0.52) PPARDPPARAPPARGNR1H3NR1H2
SCHEMBL6926183 0.85 PPARD (0.62) PPARDPPARAPPARGNR1H3NR1H2
SCHEMBL5973156 0.83 PPARD (0.53) PPARDPPARAPPARGNR1H3NR1H2
SCHEMBL5973846 0.82 PPARD (0.53) PPARDPPARAPPARGNR1H3NR1H2
SCHEMBL5972943 0.82 PPARD (0.53) PPARDPPARAPPARGNR1H3NR1H2
SCHEMBL5973052 0.80 PPARD (0.54) PPARDPPARAPPARGNR1H3NR1H2
SCHEMBL6925941 0.80 PPARD (0.54) PPARDPPARAPPARGNR1H3NR1H2
SCHEMBL5972883 0.79 PPARD (0.48) PPARDPPARAPPARGNR1H3NR1H2
SCHEMBL5973176 0.79 PPARD (0.54) PPARDPPARAPPARGNR1H3NR1H2
SCHEMBL6925949 0.74 PPARD (0.61) PPARDPPARAPPARGNR1H3NR1H2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0948327-A4 ANTIDIABETIC AGENTS MERCK & CO INC (US) 2003-04-02 EP 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-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