SCHEMBL27936024

SCHEMBL27936024

CC(C)(C)c1cccc(C=CCS(=O)(=O)n2c(Cc3ccc(C(=O)O)cc3)cc3cc(C(F)(F)F)ccc32)c1

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 8/20 0.39
▸ PPARA Q07869 7/20 0.39
▸ RORC P51449 2/20 0.38
▸ PPARD Q03181 6/20 0.38
▸ MEN1 O00255 1/20 0.36
▸ NPC1 O15118 1/20 0.36
▸ RAB9A P51151 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ NLRP3 Q96P20 3/20 0.36
▸ SRD5A2 P31213 1/20 0.36

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
Piperazine SCHEMBL27950239 0.95 PPARG (0.36) PPARGPPARARORCPPARDMEN1
SCHEMBL28810371 0.94 MEN1 (0.36) PPARGRORCMEN1NPC1RAB9A
SCHEMBL27884360 0.93 PPARG (0.38) PPARGPPARARORCPPARDMEN1
SCHEMBL27950252 0.93 PPARG (0.38) PPARGPPARARORCPPARDMEN1
SCHEMBL27936027 0.92 PPARG (0.39) PPARGPPARARORCPPARDNLRP3
SCHEMBL27936050 0.91 PPARG (0.37) PPARGPPARARORCPPARDNLRP3
SCHEMBL28807363 0.90 PPARG (0.35) PPARGPPARARORCPPARD
SCHEMBL27950245 0.90 PPARG (0.35) PPARGPPARAPPARDSRD5A2
SCHEMBL27936025 0.90 PPARG (0.36) PPARGPPARARORCPPARDNLRP3
SCHEMBL27936028 0.89 RXRA (0.36) PPARGPPARA

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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