Piperazine

Piperazine

SCHEMBL11266069

C1CNCCN1.Cc1cc(Cc2cc(C)c(O)cc2S(=O)(=O)O)c(S(=O)(=O)O)cc1O

nearest known ligand 0.37

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 14)

geneUniProtsupporting neighboursconfidence
▸ ESR1 known ✓ P03372 1/20 0.30
▸ BRD4 O60885 2/20 0.37
▸ TP53 P04637 1/20 0.37
▸ CREBBP Q92793 1/20 0.37
▸ ESR2 Q92731 2/20 0.33
▸ POLB P06746 1/20 0.33
▸ RECQL P46063 1/20 0.33
▸ ACHE P22303 3/20 0.33
▸ LMNA P02545 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ HIF1A Q16665 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.31
▸ HSPA5 P11021 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
SCHEMBL11265315 0.90 BRD4 (0.42) BRD4TP53CREBBPESR2POLB
Morpholine SCHEMBL11273353 0.90 ACHE (0.40) BRD4TP53CREBBPESR2POLB
Methylpiperazine SCHEMBL11281700 0.89 ALDH1A1 (0.35) BRD4TP53CREBBPACHEALDH1A1
Water SCHEMBL11300319 0.89 BRD4 (0.41) BRD4TP53CREBBPESR2POLB
Water SCHEMBL11271972 0.89 BRD4 (0.41) BRD4TP53CREBBPESR2POLB
Water SCHEMBL11268513 0.89 BRD4 (0.41) BRD4TP53CREBBPESR2POLB
SCHEMBL11304268 0.84 BRD4 (0.37) BRD4TP53CREBBPESR2POLB
SCHEMBL11383390 0.83 BRD4 (0.40) BRD4TP53CREBBPESR2POLB
Water SCHEMBL11268487 0.81 BRD4 (0.40) BRD4TP53CREBBPESR2POLB
SCHEMBL11390336 0.74 POLB (0.52) POLBLMNAALDH1A1

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
EP-0029990-B1 BIPHENYLMETHANE DERIVATIVE, METHODS FOR ITS PRODUCTION AND PHARMACEUTICAL COMPOSITIONS CONTAINING IT Byk Gulden Lomberg Chemische Fabrik GmbH (DE) 1982-09-08 — — EP disclosed
EP-0029990-A1 Biphenylmethane derivative, methods for its production and pharmaceutical compositions containing it Byk Gulden Lomberg Chemische Fabrik GmbH (DE) 1981-06-10 — — EP disclosed
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