SCHEMBL4029571

SCHEMBL4029571

Cc1oc(-c2ccccc2)nc1CCOc1ccccc1C(CCO)NC(=O)OC(C)(C)C

nearest known ligand 0.49

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PPARG P37231 20/20 0.49
PPARA Q07869 18/20 0.49
PPARD Q03181 5/20 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
SCHEMBL4026008 0.86 PPARG (0.58) PPARGPPARAPPARD
SCHEMBL4032690 0.80 FFAR1 (0.53) PPARGPPARA
SCHEMBL4026004 0.77 PPARG (0.61) PPARGPPARAPPARD
SCHEMBL12667532 0.76 CTSK (0.42) PPARG
SCHEMBL4026006 0.76 PPARG (0.65) PPARGPPARAPPARD
SCHEMBL6203537 0.76 PPARG (0.67) PPARGPPARAPPARD
SCHEMBL13069725 0.75 PPARG (0.59) PPARGPPARAPPARD
SCHEMBL10217306 0.75 CTSK (0.46)
SCHEMBL14044925 0.75 CTSK (0.46)
SCHEMBL5557520 0.74 PPARG (0.67) 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
EP-1569916-B1 SUBSTITUTED ARALKYL DERIVATIVES CADILA HEALTHCARE LTD (IN) 2009-01-07 EP claimed