SCHEMBL28809330

SCHEMBL28809330

CC(C)(C)c1cccc(C=CCS(=O)(=O)n2c(Cc3csc(C(=O)O)c3)cc3cc(C(F)(F)F)ccc32)c1

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 10/20 0.37
▸ PPARA Q07869 8/20 0.37
▸ PPARD Q03181 7/20 0.36
▸ RORC P51449 1/20 0.32
▸ MAOA P21397 1/20 0.31
▸ MAOB P27338 1/20 0.31
▸ ITK Q08881 1/20 0.31
▸ TP53 P04637 1/20 0.30
▸ MAPT P10636 1/20 0.30

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
SCHEMBL27936024 0.88 PPARG (0.39) PPARGPPARAPPARDRORC
SCHEMBL27936046 0.87 PPARG (0.37) PPARGPPARAPPARDMAOAMAOB
SCHEMBL27950252 0.87 PPARG (0.38) PPARGPPARAPPARDRORC
SCHEMBL27936035 0.86 PTGER1 (0.39) PPARGPPARAPPARDTP53MAPT
SCHEMBL28946335 0.85 PPARG (0.36) PPARGPPARAPPARDRORC
SCHEMBL27936050 0.85 PPARG (0.37) PPARGPPARAPPARDRORC
SCHEMBL27950301 0.85 PPARG (0.37) PPARGPPARAPPARDRORCMAOA
SCHEMBL28807364 0.84 PPARG (0.38) PPARGPPARAPPARDRORCMAOA
SCHEMBL27936025 0.84 PPARG (0.36) PPARGPPARAPPARDRORCTP53
SCHEMBL27950238 0.84 POLB (0.44) PPARGPPARAPPARDRORCMAOA

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 2 patents. 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 claimed
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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