SCHEMBL7464135

SCHEMBL7464135

CCN(CC)CCCNC(=O)c1[nH]c(Cc2ccc(Cl)cc2)nc1CN1CCC(c2ccccc2)(c2ccccc2)CC1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRA1A P35348 10/20 0.44
ADRA2A P08913 9/20 0.44
ADRA2B P18089 9/20 0.44
ADRA2C P18825 9/20 0.44
ADRA1D P25100 9/20 0.44
ADRA1B P35368 9/20 0.44
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
TP53 P04637 3/20 0.39
MAPT P10636 3/20 0.39
LMNA P02545 3/20 0.39
NSD2 O96028 1/20 0.36
ALDH1A1 P00352 1/20 0.36
CHRM4 P08173 1/20 0.36
APP P05067 1/20 0.36
USP7 Q93009 1/20 0.36
USP2 O75604 1/20 0.36
TSHR P16473 1/20 0.36
MAPK1 P28482 1/20 0.36
HTT P42858 1/20 0.36

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
SCHEMBL6978800 0.81 ADRA1A (0.43) ADRA1AADRA2AADRA2BADRA2CADRA1D
SCHEMBL6976571 0.77 ADRA1A (0.40) ADRA1AADRA2AADRA2BADRA2CADRA1D
SCHEMBL6977305 0.75 KMT2A (0.46) MEN1KMT2ATP53MAPTALDH1A1
SCHEMBL7464130 0.72 OPRD1 (0.38) ADRA1AADRA2AADRA2BADRA2CADRA1D
SCHEMBL6965116 0.70 ADRA1A (0.49) ADRA1AADRA2AADRA2BADRA2CADRA1D
SCHEMBL6979779 0.70 ADRA1A (0.41) ADRA1AADRA2AADRA2BADRA2CADRA1D
SCHEMBL6970257 0.69 OPRD1 (0.41) LMNAALDH1A1HTTL3MBTL1
SCHEMBL6975845 0.69 ADRA1A (0.42) ADRA1AADRA2AADRA2BADRA2CADRA1D
SCHEMBL6967490 0.68 OPRD1 (0.41) ADRA1AADRA2AADRA2BADRA2CADRA1D
SCHEMBL6975294 0.68 ADRA1A (0.47) ADRA1AADRA2AADRA2BADRA2CADRA1D

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-1202984-A1 NOVEL DIPHENYL-PIPERIDINE DERIVATE AstraZeneca UK Limited (GB) 2002-05-08 EP claimed
WO-2001005782-A1 NOVEL DIPHENYL-PIPERIDINE DERIVATE ASTRAZENECA UK LIMITED (GB) 2001-01-25 WO claimed