SCHEMBL6200768

SCHEMBL6200768

Cc1oc(-c2ccccc2)nc1CCOc1ccc(CC(C)Sc2ccccc2)cc1

nearest known ligand 0.66

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PPARG P37231 20/20 0.66
PPARA Q07869 12/20 0.65
PPARD Q03181 3/20 0.65

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
SCHEMBL4029473 0.89 PPARG (0.65) PPARGPPARAPPARD
SCHEMBL8258850 0.83 PPARG (0.78) PPARGPPARAPPARD
SCHEMBL7897441 0.83 PPARG (0.81) PPARGPPARAPPARD
SCHEMBL4026868 0.82 PPARG (0.70) PPARGPPARAPPARD
SCHEMBL4030873 0.82 PPARG (0.71) PPARGPPARAPPARD
SCHEMBL4030874 0.82 PPARG (0.66) PPARGPPARAPPARD
SCHEMBL3279259 0.81 PPARG (0.72) PPARGPPARAPPARD
SCHEMBL7909886 0.81 PPARG (0.77) PPARGPPARAPPARD
SCHEMBL7903504 0.81 PPARG (0.74) PPARGPPARAPPARD
SCHEMBL4389208 0.81 PPARG (0.79) 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