SCHEMBL5236702

SCHEMBL5236702

CNC(=O)COC(=O)N1CCN(c2ccc(-c3ccc(Cl)cc3)cc2)CC1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FAAH O00519 1/20 0.57
MAPT P10636 6/20 0.50
LMNA P02545 6/20 0.50
KDM4E B2RXH2 1/20 0.50
GAA P10253 1/20 0.50
HTT P42858 3/20 0.49
MAPK1 P28482 1/20 0.49
POLB P06746 1/20 0.47
SMN1; SMN2 Q16637 4/20 0.47
NPSR1 Q6W5P4 3/20 0.47
TSHR P16473 1/20 0.47
HDAC1 Q13547 1/20 0.46
AKR1C3 P42330 2/20 0.46
ALDH1A1 P00352 3/20 0.46
HPGD P15428 1/20 0.46
CYP1A2 P05177 1/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
HRH2 P25021 1/20 0.46

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
SCHEMBL5232354 0.96 FAAH (0.61) FAAHMAPTLMNAKDM4EGAA
SCHEMBL5233512 0.89 MAPT (0.51) MAPTLMNAKDM4EGAAMAPK1
SCHEMBL5235029 0.88 GAA (0.52) FAAHMAPTLMNAKDM4EGAA
SCHEMBL5233753 0.88 FAAH (0.48) FAAHMAPTLMNAKDM4EGAA
SCHEMBL5239244 0.88 ALDH1A1 (0.52) MAPTLMNAKDM4EGAAHTT
SCHEMBL5233485 0.85 NPSR1 (0.50) FAAHMAPTLMNAGAAHTT
SCHEMBL5239162 0.85 MAPT (0.53) MAPTLMNAKDM4EGAAHTT
SCHEMBL5238043 0.85 CA12 (0.50) FAAHMAPTLMNAKDM4EGAA
SCHEMBL5235359 0.85 MAPT (0.58) FAAHMAPTLMNAKDM4EGAA
SCHEMBL5236694 0.84 FAAH (0.52) FAAHMAPTLMNAGAAPOLB

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