SCHEMBL6980095

SCHEMBL6980095

CN(CCO)C(=O)Oc1c(CN2CCC(c3ccccc3)(c3ccccc3)CC2)ncn1Cc1ccc(Cl)cc1

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
OPRD1 P41143 15/20 0.38
OPRK1 P41145 11/20 0.38
OPRM1 P35372 1/20 0.37
HRH3 Q9Y5N1 1/20 0.36
OPRL1 P41146 1/20 0.36
DRD4 P21917 1/20 0.36
ALDH1A1 P00352 1/20 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
CYP11B2 P19099 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
SCHEMBL6979774 0.91 OPRD1 (0.41) OPRD1OPRK1OPRM1OPRL1ALDH1A1
SCHEMBL6978640 0.91 OPRD1 (0.40) OPRD1OPRK1OPRM1OPRL1DRD4
SCHEMBL6975631 0.88 OPRD1 (0.38) OPRD1OPRK1OPRM1OPRL1ALDH1A1
SCHEMBL6974993 0.86 CCR3 (0.41) OPRD1OPRK1OPRM1OPRL1ALDH1A1
SCHEMBL6975764 0.85 CYP11B2 (0.41) OPRD1OPRK1OPRM1HRH3DRD4
SCHEMBL6980433 0.85 OPRD1 (0.42) OPRD1OPRK1OPRM1OPRL1ALDH1A1
SCHEMBL6967337 0.84 OPRD1 (0.39) OPRD1OPRK1OPRM1OPRL1
SCHEMBL6969796 0.84 OPRD1 (0.42) OPRD1OPRK1OPRM1OPRL1ALDH1A1
SCHEMBL6976571 0.82 ADRA1A (0.40) OPRD1OPRK1OPRM1OPRL1ALDH1A1
SCHEMBL6975114 0.81 OPRD1 (0.44) OPRD1OPRK1OPRM1ALDH1A1LMNA

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-1202984-B1 DIPHENYL-PIPERIDINE DERIVATE ASTRAZENECA UK LTD (GB) 2003-03-05 EP claimed