SCHEMBL9910098

SCHEMBL9910098

Cc1ccc(-c2nc(CCOc3ccc4c(c3)CC[C@H]4CI)c(C)s2)cc1C

nearest known ligand 0.67

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 20/20 0.67
PPARG P37231 16/20 0.67
PPARD Q03181 4/20 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
SCHEMBL12601491 0.93 PPARA (0.67) PPARAPPARGPPARD
SCHEMBL13047856 0.92 PPARA (0.79) PPARAPPARGPPARD
SCHEMBL20232540 0.91 PPARA (0.79) PPARAPPARGPPARD
SCHEMBL13049216 0.90 PPARA (0.67) PPARAPPARGPPARD
SCHEMBL13048690 0.90 PPARA (0.79) PPARAPPARGPPARD
SCHEMBL13049223 0.90 PPARA (0.81) PPARAPPARGPPARD
SCHEMBL20232433 0.90 PPARA (0.79) PPARAPPARGPPARD
SCHEMBL9910203 0.90 PPARA (0.80) PPARAPPARGPPARD
SCHEMBL820630 0.89 PPARA (0.84) PPARAPPARGPPARD
SCHEMBL4679860 0.89 PPARA (0.84) PPARAPPARGPPARD

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-2012074980-A2 METHODS OF TREATING OR PREVENTING AUTOIMMUNE DISORDERS AND LIVER DISORDERS USING INDANE ACETIC ACID DERIVATIVES DARA BIOSCIENCES, INC. (US) 2012-06-07 WO disclosed