SCHEMBL7464130

SCHEMBL7464130

CCN(CC)CCCN(Cc1ccc(Cl)cc1)C(=O)c1[nH]cnc1CN1CCC(c2ccccc2)(c2ccccc2)CC1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OPRD1 P41143 2/20 0.38
OPRM1 P35372 1/20 0.36
OPRK1 P41145 1/20 0.36
ALDH1A1 P00352 2/20 0.36
LMNA P02545 1/20 0.36
GAA P10253 1/20 0.36
HTT P42858 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
HRH4 Q9H3N8 1/20 0.34
HRH3 Q9Y5N1 1/20 0.34
FFAR2 O15552 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
ADRA2A P08913 1/20 0.34
ADRA2B P18089 1/20 0.34
ADRA2C P18825 1/20 0.34
ADRA1D P25100 1/20 0.34
ADRA1A P35348 1/20 0.34
ADRA1B P35368 1/20 0.34

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 0.73 ADRA1A (0.43) OPRD1OPRK1ALDH1A1LMNAGAA
SCHEMBL6970257 0.73 OPRD1 (0.41) OPRD1OPRM1OPRK1ALDH1A1LMNA
SCHEMBL7464135 0.72 ADRA1A (0.44) ALDH1A1LMNAHTTL3MBTL1MEN1
SCHEMBL6976571 0.72 ADRA1A (0.40) OPRD1OPRM1OPRK1ALDH1A1LMNA
SCHEMBL6975114 0.71 OPRD1 (0.44) OPRD1OPRM1OPRK1ALDH1A1LMNA
SCHEMBL6975631 0.70 OPRD1 (0.38) OPRD1OPRM1OPRK1ALDH1A1LMNA
SCHEMBL6971806 0.69 OPRD1 (0.42) OPRD1OPRM1OPRK1ALDH1A1LMNA
SCHEMBL6975764 0.68 CYP11B2 (0.41) OPRD1OPRM1OPRK1ALDH1A1HRH3
SCHEMBL6972934 0.68 PKM (0.45) OPRD1OPRM1OPRK1GAA
SCHEMBL6979774 0.67 OPRD1 (0.41) OPRD1OPRM1OPRK1ALDH1A1LMNA

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