SCHEMBL5233753

SCHEMBL5233753

CNC(=O)COC(=O)N1CCN(c2ccc(-c3ccc(Cl)cc3Cl)cc2)CC1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FAAH O00519 1/20 0.48
MAPT P10636 6/20 0.48
MAPK1 P28482 2/20 0.48
HTT P42858 2/20 0.48
SMN1; SMN2 Q16637 3/20 0.48
LMNA P02545 2/20 0.48
HPGD P15428 2/20 0.48
NPSR1 Q6W5P4 1/20 0.48
TSHR P16473 2/20 0.47
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
HSD17B10 Q99714 1/20 0.45
ENPP2 Q13822 1/20 0.44
KDM4E B2RXH2 1/20 0.44
GAA P10253 1/20 0.44
ALDH1A1 P00352 2/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41

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
SCHEMBL5236702 0.88 FAAH (0.57) FAAHMAPTMAPK1HTTSMN1; SMN2
SCHEMBL5233485 0.87 NPSR1 (0.50) FAAHMAPTMAPK1HTTSMN1; SMN2
SCHEMBL5232354 0.87 FAAH (0.61) FAAHMAPTMAPK1HTTSMN1; SMN2
SCHEMBL5232412 0.86 FAAH (0.46) FAAHSMN1; SMN2HPGDTSHRMEN1
SCHEMBL5236215 0.84 FAAH (0.43) FAAHMAPTSMN1; SMN2HPGDNPSR1
SCHEMBL5237873 0.81 ALDH1A1 (0.58) FAAHMAPTMAPK1HTTSMN1; SMN2
SCHEMBL5236929 0.81 MAPT (0.73) FAAHMAPTMAPK1HTTSMN1; SMN2
SCHEMBL5232196 0.81 MAPT (0.58) FAAHMAPTMAPK1HTTSMN1; SMN2
SCHEMBL5233512 0.80 MAPT (0.51) MAPTMAPK1SMN1; SMN2LMNAHPGD
SCHEMBL5235029 0.79 GAA (0.52) FAAHMAPTMAPK1HTTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1701946-B1 DERIVATIVES OF 1-PIPERAZINE- AND 1-HOMOPIPERAZINE-CARBOXYLATES, PREPARATION METHOD THEREOF AND USE OF SAME AS INHIBITORS OF THE FAAH ENZYME SANOFI AVENTIS (FR) 2007-12-19 EP claimed