SCHEMBL4032006

SCHEMBL4032006

CCOCCCCc1ccc(OCCc2nc(-c3ccccc3)oc2C)cc1

nearest known ligand 0.64

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PPARG P37231 19/20 0.64
PPARA Q07869 18/20 0.64
PPARD Q03181 10/20 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
SCHEMBL4026020 0.95 PPARG (0.63) PPARGPPARAPPARD
SCHEMBL4033033 0.89 PPARG (0.62) PPARGPPARAPPARD
SCHEMBL5915216 0.88 PPARG (0.68) PPARGPPARAPPARD
SCHEMBL14382549 0.88 PPARG (0.71) PPARGPPARAPPARD
SCHEMBL4030770 0.87 FFAR1 (0.64) PPARGPPARAPPARD
SCHEMBL6969645 0.87 PPARG (0.67) PPARGPPARAPPARD
SCHEMBL4032153 0.85 PPARG (0.61) PPARGPPARAPPARD
SCHEMBL16144192 0.85 PPARG (0.71) PPARGPPARAPPARD
SCHEMBL4031987 0.85 PPARG (0.59) PPARGPPARAPPARD
SCHEMBL4026018 0.85 PPARG (0.60) 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