SCHEMBL5481509

SCHEMBL5481509

O=C(O)N1CCN(CCCOc2ccc(Cl)cc2)CC1

nearest known ligand 0.67

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 2/20 0.67
HRH2 P25021 1/20 0.67
HRH1 P35367 1/20 0.67
MEN1 O00255 3/20 0.65
KMT2A Q03164 3/20 0.65
KCNA5 P22460 3/20 0.64
HRH3 Q9Y5N1 10/20 0.64
ALDH1A1 P00352 1/20 0.61
L3MBTL1 Q9Y468 1/20 0.61
DRD3 P35462 2/20 0.59
HTR1A P08908 1/20 0.59
HTR2A P28223 1/20 0.59
TMEM97 Q5BJF2 1/20 0.59
SIGMAR1 Q99720 1/20 0.59

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
SCHEMBL5480208 0.93 KCNA5 (0.74) DRD2HRH2HRH1MEN1KMT2A
SCHEMBL4743140 0.89 HRH3 (0.65) DRD2HRH1MEN1KMT2AKCNA5
SCHEMBL15349833 0.87 KDM4E (0.70) DRD2HRH1MEN1KMT2AKCNA5
SCHEMBL5487964 0.86 DRD2 (0.51) DRD2HRH2HRH1MEN1KMT2A
SCHEMBL20512382 0.86 DRD2 (0.56) DRD2HRH2HRH1KCNA5HRH3
SCHEMBL2234336 0.84 HRH3 (0.59) DRD2MEN1KMT2AKCNA5HRH3
SCHEMBL3985948 0.84 HRH3 (0.67) MEN1KMT2AHRH3ALDH1A1
SCHEMBL6471513 0.83 HRH3 (0.75) HRH3ALDH1A1
SCHEMBL9809270 0.82 HRH2 (0.69) DRD2HRH2HRH1MEN1KMT2A
SCHEMBL5487159 0.81 TSHR (0.55) DRD2HRH2HRH1MEN1KMT2A

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