SCHEMBL5481359

SCHEMBL5481359

O=C(O)N1CCN(CCCCc2ccc(Cl)cc2)CC1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 7/20 0.58
DRD2 P14416 4/20 0.56
HTR1A P08908 3/20 0.56
HTR2A P28223 3/20 0.56
DRD3 P35462 3/20 0.56
DRD1 P21728 2/20 0.56
DRD5 P21918 2/20 0.56
TMEM97 Q5BJF2 2/20 0.56
HRH3 Q9Y5N1 2/20 0.55
CCR3 P51677 2/20 0.53
CACNA1G O43497 1/20 0.53
HRH1 P35367 2/20 0.51
SLC6A2 P23975 1/20 0.51
SLC6A4 P31645 1/20 0.51
HTR7 P34969 1/20 0.51
HTR2B P41595 1/20 0.51
HTR2C P28335 1/20 0.51
MEN1 O00255 1/20 0.51
KMT2A Q03164 1/20 0.51
THRB P10828 1/20 0.50

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
SCHEMBL5489773 0.92 SIGMAR1 (0.53) SIGMAR1DRD2HRH3CACNA1GHRH1
SCHEMBL27564818 0.86 SIGMAR1 (0.76) SIGMAR1CCR3MEN1KMT2AFAAH
SCHEMBL5486473 0.83 MEN1 (0.62) SIGMAR1HTR1ACCR3CACNA1GHTR7
SCHEMBL10899639 0.83 SIGMAR1 (0.66) SIGMAR1DRD2HTR1AHTR2ADRD3
Hydrochloric Acid SCHEMBL10503957 0.82 SIGMAR1 (0.66) SIGMAR1DRD2HTR1AHTR2ADRD3
SCHEMBL5477072 0.82 HRH3 (0.58) SIGMAR1HRH3SLC6A4FAAH
SCHEMBL27564901 0.81 SIGMAR1 (0.73) SIGMAR1MEN1KMT2AFAAH
SCHEMBL10933082 0.81 HRH3 (0.55) SIGMAR1DRD2HTR1AHTR2ADRD3
SCHEMBL2931705 0.81 AKR1C3 (0.65) SIGMAR1HRH3MEN1KMT2AFAAH
SCHEMBL10937634 0.80 HRH3 (0.54) SIGMAR1DRD2HTR1AHTR2ADRD3

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1720848-B1 DERIVATIVES OF ALKYLPIPERAZINE- AND ALKYLHOMOPIPERAZINE- CARBOXYLATES, PREPARATION METHOD THEREOF AND USE OF SAME AS FAAH ENZYME INHIBITORS SANOFI AVENTIS (FR) 2007-12-05 EP claimed
EP-1720848-B1 DERIVATIVES OF ALKYLPIPERAZINE- AND ALKYLHOMOPIPERAZINE- CARBOXYLATES, PREPARATION METHOD THEREOF AND USE OF SAME AS FAAH ENZYME INHIBITORS SANOFI AVENTIS (FR) 2007-12-05 EP disclosed
EP-1720848-A1 DERIVATIVES OF ALKYLPIPERAZINE- AND ALKYLHOMOPIPERAZINE- CARBOXYLATES, PREPARATION METHOD THEREOF AND USE OF SAME AS FAAH ENZYME INHIBITORS Sanofi-Aventis (FR) 2006-11-15 EP disclosed
WO-2005090322-A1 DERIVATIVES OF ALKYLPIPERAZINE- AND ALKYLHOMOPIPERAZINE- CARBOXYLATES, PREPARATION METHOD THEREOF AND USE OF SAME AS FAAH ENZYME INHIBITORS SANOFI-AVENTIS (FR) 2005-09-29 WO disclosed