SCHEMBL5487964

SCHEMBL5487964

O=C(O)N1CCN(CCCOc2cc(Cl)cc(Cl)c2)CC1

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 2/20 0.51
HRH2 P25021 1/20 0.51
HRH1 P35367 1/20 0.51
HRH3 Q9Y5N1 11/20 0.50
KDM4E B2RXH2 2/20 0.50
ALDH1A1 P00352 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
KCNA5 P22460 1/20 0.48

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
SCHEMBL3985948 0.87 HRH3 (0.67) HRH3KDM4EALDH1A1SMN1; SMN2MEN1
SCHEMBL5481509 0.86 DRD2 (0.67) DRD2HRH2HRH1HRH3ALDH1A1
SCHEMBL15349833 0.81 KDM4E (0.70) DRD2HRH1HRH3KDM4EALDH1A1
SCHEMBL5487159 0.79 TSHR (0.55) DRD2HRH2HRH1KDM4EALDH1A1
SCHEMBL5480294 0.79 HPGD (0.61) KDM4EALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL5480208 0.78 KCNA5 (0.74) DRD2HRH2HRH1HRH3ALDH1A1
SCHEMBL2179409 0.78 HRH2 (0.55) HRH2HRH1HRH3
SCHEMBL20512382 0.77 DRD2 (0.56) DRD2HRH2HRH1HRH3KDM4E
SCHEMBL5480360 0.76 POLB (0.58) DRD2HRH2HRH1KDM4EALDH1A1
SCHEMBL4743140 0.76 HRH3 (0.65) DRD2HRH1HRH3KDM4EALDH1A1

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-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