Piperazine

Piperazine

SCHEMBL27950239

C1CNCCN1.CC(C)(C)c1cccc(C=CCS(=O)(=O)n2c(Cc3ccc(C(=O)O)cc3)cc3cc(C(F)(F)F)ccc32)c1

nearest known ligand 0.38

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ESR1

The experimentally established mechanism targets of Piperazine. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 7/20 0.36
▸ PPARA Q07869 6/20 0.36
▸ RORC P51449 2/20 0.35
▸ PPARD Q03181 5/20 0.35
▸ MAOB P27338 2/20 0.34
▸ P4HB P07237 1/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ NPC1 O15118 1/20 0.34
▸ RAB9A P51151 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ MAOA P21397 1/20 0.34
▸ PTGER4 P35408 1/20 0.34
▸ PTGER2 P43116 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ NLRP3 Q96P20 1/20 0.34

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 0.95 PPARG (0.39) PPARGPPARARORCPPARDMEN1
SCHEMBL28810371 0.89 MEN1 (0.36) PPARGRORCMAOBP4HBMEN1
SCHEMBL27884360 0.89 PPARG (0.38) PPARGPPARARORCPPARDMAOB
SCHEMBL27950252 0.89 PPARG (0.38) PPARGPPARARORCPPARDMEN1
SCHEMBL27936027 0.88 PPARG (0.39) PPARGPPARARORCPPARDNLRP3
SCHEMBL27936050 0.87 PPARG (0.37) PPARGPPARARORCPPARDALDH1A1
SCHEMBL28807363 0.86 PPARG (0.35) PPARGPPARARORCPPARDMAOB
SCHEMBL27950245 0.86 PPARG (0.35) PPARGPPARAPPARD
SCHEMBL27936025 0.86 PPARG (0.36) PPARGPPARARORCPPARDP4HB
SCHEMBL27936028 0.85 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 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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