SCHEMBL27950245

SCHEMBL27950245

Cc1ccc2c(c1)cc(Cc1ccc(C(=O)O)cc1)n2S(=O)(=O)CC=Cc1cccc(C(C)(C)C)c1

nearest known ligand 0.35

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 5/20 0.35
▸ PPARA Q07869 4/20 0.35
▸ RXRA P19793 4/20 0.35
▸ RXRB P28702 2/20 0.35
▸ RARA P10276 2/20 0.34
▸ RARB P10826 2/20 0.34
▸ RARG P13631 2/20 0.34
▸ CYP26A1 O43174 1/20 0.33
▸ CYP26B1 Q9NR63 1/20 0.33
▸ CCR9 P51686 1/20 0.33
▸ SRD5A2 P31213 1/20 0.32
▸ NR1H4 Q96RI1 2/20 0.32
▸ TAS2R14 Q9NYV8 1/20 0.32
▸ THRB P10828 1/20 0.31
▸ PPARD Q03181 1/20 0.31

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
SCHEMBL27936028 0.91 RXRA (0.36) PPARGPPARARXRARXRBRARA
SCHEMBL27936024 0.90 PPARG (0.39) PPARGPPARASRD5A2PPARD
Piperazine SCHEMBL27950239 0.86 PPARG (0.36) PPARGPPARAPPARD
SCHEMBL28810371 0.85 MEN1 (0.36) PPARGSRD5A2
SCHEMBL27884360 0.83 PPARG (0.38) PPARGPPARASRD5A2PPARD
SCHEMBL27950252 0.83 PPARG (0.38) PPARGPPARANR1H4PPARD
SCHEMBL12096889 0.82 PPARG (0.50) PPARGPPARARXRARXRBRARA
SCHEMBL27936027 0.81 PPARG (0.39) PPARGPPARASRD5A2NR1H4PPARD
SCHEMBL27936038 0.81 PPARG (0.38) PPARGPPARAPPARD
SCHEMBL27936050 0.81 PPARG (0.37) 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
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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