SCHEMBL7091137

SCHEMBL7091137

C=CC1(N2CCC(n3c(Cl)nc4ccccc43)CC2)CCCCCC1

nearest known ligand 0.52

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 18/20 0.52
OPRL1 P41146 17/20 0.52
OPRD1 P41143 9/20 0.52
OPRK1 P41145 14/20 0.47
OGFRL1 Q5TC84 3/20 0.46
KCNH2 Q12809 1/20 0.45

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
SCHEMBL7096853 0.82 OPRM1 (0.66) OPRM1OPRL1OPRD1OPRK1OGFRL1
SCHEMBL6215401 0.82 OPRM1 (0.66) OPRM1OPRL1OPRD1OPRK1OGFRL1
SCHEMBL7094728 0.81 OPRM1 (0.56) OPRM1OPRL1OPRD1OPRK1OGFRL1
SCHEMBL6216571 0.81 OPRM1 (0.50) OPRM1OPRL1OPRD1OPRK1OGFRL1
SCHEMBL7092769 0.80 OPRM1 (0.49) OPRM1OPRL1OPRD1OPRK1OGFRL1
SCHEMBL1128699 0.76 TP53 (0.56) OPRM1OPRL1OPRD1OPRK1OGFRL1
SCHEMBL2635863 0.75 SMN1; SMN2 (0.53) OPRM1OPRL1OPRD1OPRK1OGFRL1
SCHEMBL7091211 0.73 OPRM1 (0.42) OPRM1OPRL1OPRD1OPRK1OGFRL1
SCHEMBL7491937 0.73 OPRM1 (0.69) OPRM1OPRL1OPRD1OPRK1
SCHEMBL6595311 0.71 OPRM1 (0.54) OPRM1OPRL1OPRD1OPRK1OGFRL1

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030109549-A1 2-Substituted-1-piperidyl benzimidazole compounds as ORL1-receptor agonists ITO FUMITAKA (JP) 2003-06-12 US disclosed
EP-1102762-B1 2-SUBSTITUTED-1-PIPERIDYL BENZIMIDAZOLE COMPOUNDS AS ORL1-RECEPTOR AGONISTS PFIZER (US) 2002-11-13 EP disclosed
EP-1102762-A2 2-SUBSTITUTED-1-PIPERIDYL BENZIMIDAZOLE COMPOUNDS AS ORL1-RECEPTOR AGONISTS PFIZER INC. (US) 2001-05-30 EP disclosed
US-6172067-B1 ANALGESICS, ANTIINFLAMMATORY AGENTS PFIZER INC. 2001-01-09 US disclosed
WO-2000008013-A2 2-SUBSTITUTED-1-PIPERIDYL BENZIMIDAZOLE COMPOUNDS AS ORL1-RECEPTOR AGONISTS PFIZER PHARMACEUTICALS INC. (JP) 2000-02-17 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030109549-A1 2-Substituted-1-piperidyl benzimidazole compounds as ORL1-receptor agonists OPRL1, ORMDL3, OPRM1 OPRM1 3/4885OPRL1 1/4885OPRD1 5/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.