SCHEMBL9696349

SCHEMBL9696349

CN(C)c1ccccc1CCCCCC(Oc1ccc(C(C)(C)C)cc1)C(=O)O

nearest known ligand 0.45

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PPARG P37231 13/20 0.45
PPARA Q07869 12/20 0.45
SLC6A9 P48067 2/20 0.42
CTRC Q99895 1/20 0.41
MEN1 O00255 2/20 0.39
RAB9A P51151 2/20 0.39
KMT2A Q03164 2/20 0.39
NPSR1 Q6W5P4 1/20 0.39
PTGES O14684 1/20 0.39
ALOX5 P09917 1/20 0.39

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
SCHEMBL9695301 0.85 PPARA (0.45) PPARGPPARACTRCMEN1KMT2A
SCHEMBL9696796 0.84 PPARG (0.63) PPARGPPARACTRCPTGESALOX5
SCHEMBL9614239 0.84 PPARG (0.63) PPARGPPARACTRCPTGESALOX5
SCHEMBL9696319 0.81 PPARG (0.61) PPARGPPARACTRCPTGESALOX5
SCHEMBL9613840 0.78 PPARG (0.59) PPARGPPARACTRCMEN1RAB9A
SCHEMBL9614213 0.77 PPARA (0.56) PPARGPPARACTRCMEN1RAB9A
SCHEMBL9696474 0.77 PPARG (0.56) PPARGPPARACTRCPTGESALOX5
SCHEMBL9614218 0.76 PPARA (0.73) PPARGPPARA
SCHEMBL9614193 0.76 PPARA (0.73) PPARGPPARA
SCHEMBL9696941 0.76 PPARG (0.48) PPARGPPARASLC6A9CTRC

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-0507238-A1 Optically active carboxylic acids and medicinal preparations containing them Roche Diagnostics GmbH (DE) 1992-10-07 EP disclosed