SCHEMBL6816032

SCHEMBL6816032

COc1c(CCC(=O)O)cccc1OCCc1nc(-c2ccccc2)oc1C

nearest known ligand 0.57

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PPARG P37231 18/20 0.57
PPARA Q07869 17/20 0.57
PPARD Q03181 5/20 0.55
FFAR1 O14842 1/20 0.54

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
SCHEMBL6817025 0.91 PPARG (0.51) PPARGPPARAPPARD
SCHEMBL4393183 0.82 PPARG (0.60) PPARGPPARAPPARDFFAR1
SCHEMBL6817219 0.82 PPARG (0.53) PPARGPPARAPPARD
SCHEMBL4391342 0.82 PPARG (0.59) PPARGPPARAPPARDFFAR1
SCHEMBL6180496 0.81 PPARG (0.68) PPARGPPARAPPARDFFAR1
SCHEMBL9755734 0.80 PPARG (0.54) PPARGPPARAPPARD
SCHEMBL4034559 0.79 KDM4E (0.73) PPARGPPARAPPARDFFAR1
SCHEMBL6616213 0.78 PPARG (0.50) PPARGPPARAPPARDFFAR1
SCHEMBL6815601 0.78 PPARG (0.50) PPARGPPARAPPARD
SCHEMBL6815608 0.78 PPARG (0.50) PPARGPPARAPPARD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2004011446-A1 INDANE, DIHYDROBENZOFURAN, AND TETRAHYDRONAPHTHALENE CARBOXYLIC ACID DERIVATIVES AND THEIR USE AS ANTIDIABETICS BAYER PHARMACEUTICALS CORPORATION (US) 2004-02-05 WO disclosed