SCHEMBL5097669

SCHEMBL5097669

O=C(O)CCc1ccc(OCCOc2cc(C(=O)O)nc3ccc(F)cc23)cc1

nearest known ligand 0.53

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PPARG P37231 3/20 0.53
PPARA Q07869 2/20 0.53
FFAR1 O14842 13/20 0.46
LMNA P02545 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
FFAR4 Q5NUL3 8/20 0.46
PPARD Q03181 1/20 0.46

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
SCHEMBL5097666 0.89 PPARA (0.42) PPARGPPARAL3MBTL1PPARD
SCHEMBL5088616 0.84 MEN1 (0.44) LMNA
SCHEMBL5098762 0.84 KDM4E (0.43) PPARGPPARALMNAPPARD
SCHEMBL5141934 0.83 FFAR4 (0.45) PPARGPPARAFFAR1LMNAL3MBTL1
SCHEMBL5093263 0.83 SCN9A (0.43)
SCHEMBL5090505 0.82 PLA2G2A (0.48) PPARG
SCHEMBL5088654 0.81 CYSLTR1 (0.45) PPARGPPARAPPARD
SCHEMBL5098674 0.81 PLA2G2A (0.47)
SCHEMBL5088530 0.81 DHODH (0.42) PPARG
SCHEMBL5097600 0.78 ALOX15 (0.42)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7470708-B2 Acidic quinoline derivatives and their use for the prevention and/or treatment of hyperglycaemia-related pathologies MERCK PATENT GESELLSCHAFT MIT BESCHRAENKTER HAFTUNG (DE) 2008-12-30 US disclosed
US-7470708-B2 Acidic quinoline derivatives and their use for the prevention and/or treatment of hyperglycaemia-related pathologies MERCK PATENT GESELLSCHAFT MIT BESCHRAENKTER HAFTUNG (DE) 2008-12-30 US disclosed
US-7470708-B2 Acidic quinoline derivatives and their use for the prevention and/or treatment of hyperglycaemia-related pathologies MERCK PATENT GESELLSCHAFT MIT BESCHRAENKTER HAFTUNG (DE) 2008-12-30 US disclosed