SCHEMBL5482274

SCHEMBL5482274

O=C(O)N1CCN(CCCOc2ccccc2Cl)CC1

nearest known ligand 0.64

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 4/20 0.62
CYP1A2 P05177 1/20 0.62
CYP2D6 P10635 1/20 0.62
CYP2C19 P33261 1/20 0.62
KCNA5 P22460 2/20 0.59
TSHR P16473 1/20 0.56
KMT2A Q03164 7/20 0.55
MEN1 O00255 6/20 0.55
SMN1; SMN2 Q16637 3/20 0.55
LMNA P02545 1/20 0.55
MAPT P10636 1/20 0.55
ALDH1A1 P00352 7/20 0.54
KDM4E B2RXH2 3/20 0.54
TP53 P04637 1/20 0.52
HTT P42858 1/20 0.51
GAA P10253 1/20 0.51
HTR1A P08908 1/20 0.51
PKM P14618 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
SCHEMBL5486856 0.90 ALDH1A1 (0.69) L3MBTL1CYP1A2CYP2D6CYP2C19KCNA5
SCHEMBL5480360 0.85 POLB (0.58) L3MBTL1KCNA5KMT2AMEN1SMN1; SMN2
SCHEMBL5480294 0.84 HPGD (0.61) KCNA5TSHRKMT2AMEN1SMN1; SMN2
SCHEMBL5487159 0.84 TSHR (0.55) CYP1A2CYP2D6CYP2C19KCNA5TSHR
SCHEMBL20512386 0.82 POLB (0.48) L3MBTL1CYP1A2CYP2D6CYP2C19KCNA5
SCHEMBL2236755 0.82 ALDH1A1 (0.50) KCNA5TSHRKMT2AMEN1SMN1; SMN2
SCHEMBL15349833 0.81 KDM4E (0.70) KCNA5KMT2AMEN1SMN1; SMN2ALDH1A1
SCHEMBL11543769 0.81 CYP2D6 (0.70) L3MBTL1CYP1A2CYP2D6CYP2C19KCNA5
SCHEMBL11539872 0.81 L3MBTL1 (0.91) L3MBTL1CYP1A2CYP2D6CYP2C19TSHR
SCHEMBL11538265 0.80 CYP2D6 (0.88) L3MBTL1CYP1A2CYP2D6CYP2C19TSHR

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