SCHEMBL15844800

SCHEMBL15844800

ClCc1nc2ccccc2n1[C@H]1C[C@H]2CCC[C@@H](C1)N2[C@H]1C[C@@H]2CCC[C@@H](C2)C1

nearest known ligand 0.81

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
OGFRL1 Q5TC84 18/20 0.81
OPRL1 P41146 18/20 0.81
OPRK1 P41145 10/20 0.81
OPRM1 P35372 8/20 0.81
OPRD1 P41143 7/20 0.81

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
SCHEMBL15853832 1.00 OGFRL1 (0.81) OGFRL1OPRL1OPRK1OPRM1OPRD1
SCHEMBL15844799 1.00 OGFRL1 (0.81) OGFRL1OPRL1OPRK1OPRM1OPRD1
SCHEMBL17251625 0.89 OGFRL1 (0.79) OGFRL1OPRL1OPRK1OPRM1OPRD1
SCHEMBL15853835 0.89 OGFRL1 (1.00) OGFRL1OPRL1OPRK1OPRM1OPRD1
SCHEMBL15853716 0.89 OGFRL1 (0.79) OGFRL1OPRL1OPRK1OPRM1OPRD1
SCHEMBL15853873 0.89 OGFRL1 (1.00) OGFRL1OPRL1OPRK1OPRM1OPRD1
SCHEMBL17254402 0.89 OGFRL1 (1.00) OGFRL1OPRL1OPRK1OPRM1OPRD1
SCHEMBL16937917 0.84 OGFRL1 (0.80) OGFRL1OPRL1OPRK1OPRM1OPRD1
SCHEMBL15854399 0.83 OGFRL1 (0.69) OGFRL1OPRL1OPRK1OPRM1OPRD1
SCHEMBL15844690 0.83 OGFRL1 (0.69) OGFRL1OPRL1OPRK1OPRM1OPRD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9598411-B2 Substituted benzimidazole-type piperidine compounds and uses thereof PURDUE PHARMA L.P. (US) 2017-03-21 US disclosed
US-20150322066-A1 SUBSTITUTED BENZIMIDAZOLE-TYPE PIPERIDINE COMPOUNDS AND USES THEREOF PURDUE PHARMA L.P. 2015-11-12 US disclosed
US-9090618-B2 Substituted benzimidazole-type piperidine compounds and uses thereof PURDUE PHARMA L.P. (US) 2015-07-28 US disclosed
US-20140187535-A1 SUBSTITUTED BENZIMIDAZOLE-TYPE PIPERIDINE COMPOUNDS AND USES THEREOF SHIONOGI & CO., LTD. (JP) 2014-07-03 US 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 (2 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-20140187535-A1 SUBSTITUTED BENZIMIDAZOLE-TYPE PIPERIDINE COMPOUNDS AND USES THEREOF H1-0, H1-3, CACNA1A OGFRL1 2889/4885OPRL1 181/4885OPRK1 27/4885
US-20150322066-A1 SUBSTITUTED BENZIMIDAZOLE-TYPE PIPERIDINE COMPOUNDS AND USES THEREOF H1-0, H1-3, CACNA1A OGFRL1 2889/4885OPRL1 181/4885OPRK1 27/4885

“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.