SCHEMBL5709490

SCHEMBL5709490

CCN(C(=O)O)C1CCN(Cc2cc(C)cc(Cl)c2)CC1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 3/20 0.51
CHRM2 P08172 2/20 0.46
CHRM3 P20309 2/20 0.46
UBE2M P61081 1/20 0.43
DCUN1D1 Q96GG9 1/20 0.43
SIGMAR1 Q99720 3/20 0.43
DRD2 P14416 2/20 0.43
HTR2A P28223 2/20 0.43
HTR2C P28335 2/20 0.43
HTR2B P41595 2/20 0.43
KDM4E B2RXH2 2/20 0.42
ALDH1A1 P00352 2/20 0.42
KCNH2 Q12809 2/20 0.42
CACNA1I Q9P0X4 1/20 0.42
GPR119 Q8TDV5 1/20 0.41
CCR5 P51681 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
SCHEMBL5709432 0.93 OPRM1 (0.55) OPRM1CHRM2CHRM3SIGMAR1DRD2
SCHEMBL27654948 0.82 CCR5 (0.41) OPRM1CHRM2CHRM3UBE2MDCUN1D1
SCHEMBL5709507 0.79 OPRM1 (0.52) OPRM1CHRM2CHRM3UBE2MDCUN1D1
SCHEMBL5709427 0.77 OPRM1 (0.64) OPRM1CHRM2CHRM3SIGMAR1DRD2
SCHEMBL5709506 0.76 SIGMAR1 (0.50) OPRM1SIGMAR1CCR5
SCHEMBL5709465 0.76 OPRM1 (0.48) OPRM1CHRM2CHRM3UBE2MDCUN1D1
SCHEMBL3937369 0.74 ACHE (0.54) KCNH2CACNA1I
SCHEMBL5709408 0.74 ACHE (0.59) OPRM1CHRM2CHRM3SIGMAR1
SCHEMBL5709413 0.73 OPRM1 (0.45) OPRM1CHRM2CHRM3UBE2MDCUN1D1
Hydrochloric Acid SCHEMBL1814858 0.73 OPRM1 (0.62) OPRM1CHRM2CHRM3SIGMAR1DRD2

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-1720550-A1 DERIVATIVES OF PIPERIDINYLALKYLCARBAMATES, PREPARATION METHOD THEREOF AND USE OF SAME AS FAAH ENZYME INHIBITORS Sanofi-Aventis (FR) 2006-11-15 EP disclosed
WO-2005089759-A1 DERIVATIVES OF PIPERIDINYLALKYLCARBAMATES, PREPARATION METHOD THEREOF AND USE OF SAME AS FAAH ENZYME INHIBITORS SANOFI-AVENTIS (FR) 2005-09-29 WO disclosed