SCHEMBL6969075

SCHEMBL6969075

NC(=O)CNC(=O)Oc1c(CN2CCC(c3ccccc3)(c3ccccc3)CC2)ncn1Cc1ccc(Cl)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OPRD1 P41143 15/20 0.38
OPRK1 P41145 12/20 0.38
OPRL1 P41146 1/20 0.37
ADRA2A P08913 1/20 0.36
ADRA2B P18089 1/20 0.36
ADRA2C P18825 1/20 0.36
ADRA1D P25100 1/20 0.36
ADRA1A P35348 1/20 0.36
ADRA1B P35368 1/20 0.36
CCR3 P51677 1/20 0.36
OPRM1 P35372 1/20 0.36
NPFFR1 Q9GZQ6 1/20 0.35
NPFFR2 Q9Y5X5 1/20 0.35
ADAMTS4 O75173 1/20 0.35
MMP1 P03956 1/20 0.35
MMP2 P08253 1/20 0.35
MMP3 P08254 1/20 0.35
MMP7 P09237 1/20 0.35
MMP9 P14780 1/20 0.35
MMP8 P22894 1/20 0.35

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
SCHEMBL6967337 0.90 OPRD1 (0.39) OPRD1OPRK1OPRL1ADRA2AADRA2B
SCHEMBL6973626 0.89 OPRD1 (0.40) OPRD1OPRK1OPRL1ADRA2AADRA2B
SCHEMBL6969796 0.89 OPRD1 (0.42) OPRD1OPRK1OPRL1CCR3OPRM1
SCHEMBL6980433 0.88 OPRD1 (0.42) OPRD1OPRK1OPRL1CCR3OPRM1
SCHEMBL6971228 0.88 ADRA1A (0.44) OPRD1OPRK1OPRL1ADRA2AADRA2B
SCHEMBL6980217 0.88 ACHE (0.43) OPRD1ADRA2AADRA2BADRA2CADRA1D
SCHEMBL6974993 0.87 CCR3 (0.41) OPRD1OPRK1OPRL1CCR3OPRM1
SCHEMBL6978058 0.87 ADRA1A (0.46) OPRD1OPRK1OPRL1ADRA2AADRA2B
SCHEMBL6979664 0.87 OPRD1 (0.37) OPRD1OPRK1OPRL1ADRA2AADRA2B
SCHEMBL6979637 0.87 ALDH1A1 (0.40) OPRD1OPRK1OPRL1OPRM1

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