SCHEMBL5239789

SCHEMBL5239789

CNC(=O)COC(=O)N1CCN(C(=O)OCC(=O)NC)CC1

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
FAAH O00519 1/20 0.51
ALDH1A1 P00352 4/20 0.44
KDM4E B2RXH2 3/20 0.44
POLB P06746 4/20 0.44
HTT P42858 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
MAPT P10636 3/20 0.42
ABL1 P00519 1/20 0.42
RIN1 Q13671 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
RECQL P46063 1/20 0.42
TSHR P16473 1/20 0.41
GAA P10253 3/20 0.40
HPGD P15428 1/20 0.39
THRB P10828 1/20 0.39
ATM Q13315 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
LMNA P02545 1/20 0.38

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
SCHEMBL5239781 0.93 FAAH (0.47) FAAHALDH1A1KDM4EPOLBHTT
SCHEMBL27659208 0.90 FAAH (0.48) FAAHALDH1A1KDM4EPOLBHTT
SCHEMBL27681399 0.88 FAAH (0.44) FAAHALDH1A1KDM4EPOLBHTT
SCHEMBL593633 0.88 USP2 (0.47) FAAHALDH1A1HTTSMN1; SMN2MAPT
SCHEMBL27679302 0.87 FAAH (0.46) FAAHALDH1A1KDM4EPOLBHTT
SCHEMBL13793796 0.87 TSHR (0.61) FAAHALDH1A1POLBHTTSMN1; SMN2
Hydrochloric Acid SCHEMBL594772 0.86 FAAH (0.45) FAAHALDH1A1KDM4EPOLBHTT
SCHEMBL5239407 0.82 MAPT (0.52) FAAHALDH1A1KDM4EPOLBHTT
SCHEMBL5235359 0.81 MAPT (0.58) FAAHALDH1A1KDM4EHTTSMN1; SMN2
SCHEMBL5233900 0.80 ALDH1A1 (0.55) ALDH1A1KDM4EPOLBHTTSMN1; 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 3 patents. 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 disclosed
EP-1701946-A2 DERIVATIVES OF 1-PIPERAZINE- AND 1-HOMOPIPERAZINE-CARBOXYLATES, PREPARATION METHOD THEREOF AND USE OF SAME AS INHIBITORS OF THE FAAH ENZYME Sanofi-Aventis (FR) 2006-09-20 EP disclosed
WO-2005070910-A2 DERIVATIVES OF 1-PIPERAZINE- AND 1-HOMOPIPERAZINE-CARBOXYLATES, PREPARATION METHOD THEREOF AND USE OF SAME AS INHIBITORS OF THE FAAH ENZYME SANOFI-AVENTIS (FR) 2005-08-04 WO disclosed