SCHEMBL27360346

SCHEMBL27360346

CCOOC(=O)C(CC)N1CCNCC1

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 3/20 0.38
OPRD1 P41143 8/20 0.35
OPRM1 P35372 4/20 0.32
CHRM5 P08912 1/20 0.32
CHRM3 P20309 1/20 0.32
ALDH1A1 P00352 1/20 0.30
LMNA P02545 1/20 0.30
MAPT P10636 1/20 0.30
HPGD P15428 1/20 0.30
RAB9A P51151 1/20 0.30
KMT2A Q03164 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
SLC6A2 P23975 1/20 0.30
SLC6A4 P31645 1/20 0.30

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
Hydrochloric Acid SCHEMBL27363845 0.98 SIGMAR1 (0.37) SIGMAR1OPRD1OPRM1CHRM5CHRM3
SCHEMBL6422237 0.85 SIGMAR1 (0.40) SIGMAR1OPRD1OPRM1CHRM5CHRM3
Hydrochloric Acid SCHEMBL7957925 0.83 SIGMAR1 (0.40) SIGMAR1OPRD1OPRM1CHRM5CHRM3
SCHEMBL22360609 0.81 SIGMAR1 (0.43) SIGMAR1OPRD1OPRM1CHRM5CHRM3
SCHEMBL27667325 0.77 SIGMAR1 (0.44) SIGMAR1OPRD1OPRM1CHRM5CHRM3
SCHEMBL4236955 0.75 SIGMAR1 (0.43) SIGMAR1OPRD1OPRM1CHRM5CHRM3
SCHEMBL1494478 0.75 SIGMAR1 (0.43) SIGMAR1OPRD1OPRM1CHRM5CHRM3
SCHEMBL7590414 0.75 SIGMAR1 (0.43) SIGMAR1OPRD1OPRM1CHRM5CHRM3
SCHEMBL29926322 0.74 SIGMAR1 (0.42) SIGMAR1OPRD1OPRM1CHRM5CHRM3
Hydrochloric Acid SCHEMBL28404227 0.74 SIGMAR1 (0.42) SIGMAR1OPRD1OPRM1CHRM5CHRM3

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
CN-1072661-C Novel substituted [2-(1-piperazinyl) ethoxy] methyl UCB SA (BE) 2001-10-10 CN claimed
CN-1215395-A Novel substituted [2-(1-piperazinyl) ethoxy] methyl UCB SA (BE) 1999-04-28 CN claimed