SCHEMBL6926269

SCHEMBL6926269

CCCc1c(OCCc2ncc3ccc(CC(=O)O)cc3n2)ccc2c(-c3ccccc3)noc12

nearest known ligand 0.67

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PPARG P37231 19/20 0.67
PPARD Q03181 19/20 0.67
PPARA Q07869 19/20 0.67

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
SCHEMBL6927599 0.89 PPARG (0.69) PPARGPPARDPPARA
SCHEMBL6928324 0.85 PPARD (0.52) PPARGPPARDPPARA
SCHEMBL7042418 0.82 PPARA (0.79) PPARGPPARDPPARA
SCHEMBL5973856 0.82 PPARG (0.68) PPARGPPARDPPARA
SCHEMBL5973387 0.81 PPARG (0.67) PPARGPPARDPPARA
SCHEMBL7042295 0.81 PPARA (1.00) PPARGPPARDPPARA
SCHEMBL5973747 0.80 PPARD (0.66) PPARGPPARDPPARA
SCHEMBL2896562 0.80 PPARA (1.00) PPARGPPARDPPARA
SCHEMBL6925949 0.80 PPARD (0.61) PPARGPPARDPPARA
SCHEMBL7039666 0.78 PPARG (0.84) PPARGPPARDPPARA

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