SCHEMBL6203537

SCHEMBL6203537

Cc1oc(-c2ccccc2)nc1CCOc1ccc(C[C@H](C)NC(=O)OC(C)(C)C)cc1

nearest known ligand 0.67

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PPARG P37231 20/20 0.67
PPARA Q07869 13/20 0.65
PPARD Q03181 6/20 0.63

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
SCHEMBL7914288 0.90 PPARG (0.68) PPARGPPARAPPARD
SCHEMBL2925571 0.90 PPARG (0.68) PPARGPPARAPPARD
SCHEMBL4026006 0.90 PPARG (0.65) PPARGPPARAPPARD
SCHEMBL4026004 0.87 PPARG (0.61) PPARGPPARAPPARD
SCHEMBL7903513 0.85 PPARG (0.68) PPARGPPARAPPARD
SCHEMBL13721247 0.84 PPARG (0.63) PPARGPPARAPPARD
SCHEMBL7897417 0.84 PPARG (0.70) PPARGPPARAPPARD
SCHEMBL7897370 0.84 PPARG (0.67) PPARGPPARAPPARD
SCHEMBL13633799 0.83 PPARG (0.62) PPARGPPARAPPARD
SCHEMBL5557520 0.83 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1569916-A1 SUBSTITUTED ARALKYL DERIVATIVES CADILA HEALTHCARE LTD. (IN) 2005-09-07 EP disclosed
WO-2004046119-A1 SUBSTITUTED ARALKYL DERIVATIVES CADILA HEALTHCARE LIMITED (IN) 2004-06-03 WO disclosed