Piperazine

Piperazine

SCHEMBL7803530

C1CNCCN1.COc1nc2ccccc2nc1NC(=O)Sc1ccccc1

nearest known ligand 0.40

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 20)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
KDM4E B2RXH2 3/20 0.39
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
ALOX15 P16050 2/20 0.34
ALDH1A1 P00352 1/20 0.34
HPGD P15428 1/20 0.34
MAPK1 P28482 1/20 0.34
HSD17B10 Q99714 1/20 0.34
RXFP1 Q9HBX9 1/20 0.34
NR1I2 O75469 1/20 0.34
LMNA P02545 1/20 0.34
CYP1A2 P05177 1/20 0.34
MAPK14 Q16539 1/20 0.34
PADI4 Q9UM07 1/20 0.34
PIM1 P11309 1/20 0.33
PIM2 Q9P1W9 1/20 0.33
HRH4 Q9H3N8 1/20 0.33
HTR2A P28223 1/20 0.32

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
SCHEMBL6559647 0.93 HDAC6 (0.45) HDAC6L3MBTL1KDM4EMEN1KMT2A
SCHEMBL6561300 0.80 GAA (0.39) HDAC6L3MBTL1KDM4EMEN1KMT2A
Piperazine SCHEMBL7803531 0.75 ALDH1A1 (0.35) HDAC6L3MBTL1KDM4EMEN1KMT2A
SCHEMBL6956521 0.74 MAPT (0.42) HDAC6L3MBTL1KDM4EMEN1KMT2A
Phenylpiperazine SCHEMBL7795027 0.70 GAA (0.46) L3MBTL1KDM4EMEN1KMT2AALDH1A1
SCHEMBL6560382 0.70 ALDH1A1 (0.50) HDAC6L3MBTL1KDM4EMEN1KMT2A
SCHEMBL7803549 0.67 HTR6 (0.53) LMNAHTR2A
SCHEMBL6962159 0.67 L3MBTL1 (0.40) L3MBTL1KDM4EMEN1KMT2AALDH1A1
SCHEMBL3442752 0.67 ALDH1A1 (0.53) L3MBTL1KDM4EMEN1KMT2AALDH1A1
SCHEMBL7795033 0.66 MAPT (0.40) L3MBTL1KDM4EMEN1KMT2AALDH1A1

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-1075469-A1 PIPERAZINE DERIVATIVES AND PROCESS FOR THE PREPARATION THEREOF Samjin Pharmaceutical Co., Ltd. (KR) 2001-02-14 EP disclosed
WO-2000052001-A1 PIPERAZINE DERIVATIVES AND PROCESS FOR THE PREPARATION THEREOF SAMJIN PHARMACEUTICAL CO., LTD. (KR) 2000-09-08 WO disclosed