SCHEMBL28807352

SCHEMBL28807352

COc1ccc(Cc2cc3cc(C(F)(F)F)ccc3n2S(=O)(=O)CC=Cc2cccc(C(C)(C)C)c2)cc1C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 9/20 0.43
▸ PPARA Q07869 10/20 0.39
▸ PPARD Q03181 6/20 0.39
▸ ALOX5 P09917 1/20 0.34
▸ RORC P51449 1/20 0.34
▸ MAOB P27338 1/20 0.33
▸ ABCB1 P08183 1/20 0.33
▸ NAMPT P43490 1/20 0.32
▸ CETP P11597 1/20 0.32

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
SCHEMBL27950301 0.90 PPARG (0.37) PPARGPPARAPPARDRORCMAOB
SCHEMBL28807364 0.88 PPARG (0.38) PPARGPPARAPPARDRORCMAOB
SCHEMBL27936024 0.87 PPARG (0.39) PPARGPPARAPPARDRORC
SCHEMBL27950253 0.87 PPARG (0.43) PPARGPPARAPPARDALOX5MAOB
SCHEMBL27950252 0.86 PPARG (0.38) PPARGPPARAPPARDRORC
SCHEMBL12096757 0.84 PPARG (0.54) PPARGPPARAPPARDRORC
SCHEMBL27950238 0.84 POLB (0.44) PPARGPPARAPPARDRORCMAOB
Piperazine SCHEMBL27950239 0.83 PPARG (0.36) PPARGPPARAPPARDRORCMAOB
SCHEMBL28809330 0.83 PPARG (0.37) PPARGPPARAPPARDRORCMAOB
SCHEMBL27936050 0.83 PPARG (0.37) PPARGPPARAPPARDRORC

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
CN-103554006-A Use of indole derivatives as nurr-1 activators for the application thereof as a medicament for the treatment of parkinson's disease FOURNIER LAB SA 2014-02-05 — — CN disclosed
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