SCHEMBL5156523

SCHEMBL5156523

CN(C)C1(c2ccccc2)CCC(C(=O)O)CC1

nearest known ligand 0.62

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 17/20 0.62
OPRM1 P35372 14/20 0.60
OPRK1 P41145 2/20 0.60

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 SCHEMBL5449940 0.98 OPRL1 (0.60) OPRL1OPRM1OPRK1
SCHEMBL4051249 0.87 OPRL1 (0.63) OPRL1OPRM1OPRK1
Hydrochloric Acid SCHEMBL4056476 0.85 OPRL1 (0.61) OPRL1OPRM1OPRK1
SCHEMBL7814234 0.82 RAB9A (0.42) OPRL1OPRM1
SCHEMBL19151630 0.81 OPRL1 (0.55) OPRL1OPRM1OPRK1
SCHEMBL5454663 0.81 OPRL1 (0.51) OPRL1OPRM1OPRK1
SCHEMBL5382074 0.80 OPRL1 (0.68) OPRL1OPRM1OPRK1
SCHEMBL2780290 0.79 OPRL1 (0.59) OPRL1OPRM1OPRK1
SCHEMBL1041409 0.78 OPRL1 (0.49) OPRL1OPRM1OPRK1
SCHEMBL9682242 0.78 MEN1 (0.48) OPRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1751095-B1 SUBSTITUTED CYCLOHEXYLCARBOXYLIC ACID DERIVATIVES GRUENENTHAL GMBH (DE) 2014-06-18 EP claimed
US-7241802-B2 Substituted cyclohexylcarboxylic acid amide compounds GRUENENTHAL GMBH (DE) 2007-07-10 US claimed
US-20070105941-A1 Substituted cyclohexylcarboxylic acid amide compounds GRUENENTHAL GMBH (DE) 2007-05-10 US claimed
CN-108602777-A 3- ((miscellaneous -) aryl)-alkyl -8- amino -2- oxos -1,3- aza-spiro-[4.5]-decane derivative 格吕伦塔尔有限公司 2018-09-28 CN disclosed
EP-1751095-B1 SUBSTITUTED CYCLOHEXYLCARBOXYLIC ACID DERIVATIVES GRUENENTHAL GMBH (DE) 2014-06-18 EP disclosed
US-7241802-B2 Substituted cyclohexylcarboxylic acid amide compounds GRUENENTHAL GMBH (DE) 2007-07-10 US disclosed
US-20070105941-A1 Substituted cyclohexylcarboxylic acid amide compounds GRUENENTHAL GMBH (DE) 2007-05-10 US disclosed
EP-1751095-A1 SUBSTITUTED CYCLOHEXYLCARBOXYLIC ACID DERIVATIVES Grünenthal GmbH (DE) 2007-02-14 EP disclosed
WO-2005110977-A1 SUBSTITUTED CYCLOHEXYLCARBOXYLIC ACID DERIVATIVES Grünenthal GmbH (DE) 2005-11-24 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-20070105941-A1 Substituted cyclohexylcarboxylic acid amide compounds OPRL1, OPRK1, HCAR1 OPRL1 1/4885OPRM1 5/4885OPRK1 2/4885

“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.