Alvimopan

Alvimopan

SCHEMBL5953724

CC1CN(CC(Cc2ccccc2)C(=O)NCC(=O)O)CCC1(C)c1cccc(O)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

OPRM1

The experimentally established mechanism targets of Alvimopan. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
OPRM1 known ✓ P35372 14/20 1.00
OPRD1 P41143 14/20 1.00
OPRK1 P41145 11/20 1.00
KCNE1 P15382 1/20 1.00
KCNQ1 P51787 1/20 1.00
CACNA1C Q13936 1/20 1.00

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
Alvimopan SCHEMBL19367975 1.00 OPRM1 (1.00) OPRM1OPRD1OPRK1KCNE1KCNQ1
Alvimopan SCHEMBL12188165 1.00 OPRM1 (1.00) OPRM1OPRD1OPRK1KCNE1KCNQ1
Alvimopan SCHEMBL16449956 1.00 OPRM1 (1.00) OPRM1OPRD1OPRK1KCNE1KCNQ1
Alvimopan SCHEMBL13913401 1.00 OPRM1 (1.00) OPRM1OPRD1OPRK1KCNE1KCNQ1
Alvimopan SCHEMBL19367933 1.00 OPRM1 (1.00) OPRM1OPRD1OPRK1KCNE1KCNQ1
Alvimopan SCHEMBL14995531 1.00 OPRM1 (1.00) OPRM1OPRD1OPRK1KCNE1KCNQ1
Alvimopan SCHEMBL25348849 1.00 OPRM1 (1.00) OPRM1OPRD1OPRK1KCNE1KCNQ1
Alvimopan SCHEMBL49578 1.00 OPRM1 (1.00) OPRM1OPRD1OPRK1KCNE1KCNQ1
Alvimopan SCHEMBL1477341 0.99 OPRM1 (0.98) OPRM1OPRD1OPRK1KCNE1KCNQ1
Alvimopan SCHEMBL8786261 0.99 OPRM1 (0.98) OPRM1OPRD1OPRK1KCNE1KCNQ1

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 56 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150126554-A1 METHODS OF PREVENTING AND TREATING GASTROINTESTINAL DYSFUNCTION ADOLOR CORPORATION 2015-05-07 US claimed
US-8946262-B2 Methods of preventing and treating gastrointestinal dysfunction ADOLOR CORPORATION (US) 2015-02-03 US claimed
US-20060211733-A1 Methods of preventing and treating opioid bowel dysfunction ADOLOR CORPORATION (US) 2006-09-21 US claimed
WO-2006096577-A2 METHODS OF PREVENTING AND TREATING OPIOID BOWEL DYSFUNCTION ADOLOR CORPORATION (US) 2006-09-14 WO claimed
US-20050148630-A1 Methods of preventing and treating non-opioid induced gastrointestinal dysfunction GLAXO GROUP LIMITED (GB) 2005-07-07 US claimed
WO-2005055953-A2 METHODS OF PREVENTING AND TREATING GASTROINTESTINAL DYSFUNCTION ADOLOR CORPORATION (US) 2005-06-23 WO claimed
WO-2005056011-A1 METHODS OF PREVENTING AND TREATING NON-OPIOID INDUCED GASTROINTESTINAL DYSFUNCTION ADOLOR CORPORATION (US) 2005-06-23 WO claimed
US-20050124657-A1 Administering aryl piperidine compound before surgery to treat gastrointestinal disorders and to relieve stress associated with surgery MERCK SHARP & DOHME LLC 2005-06-09 US claimed
US-20210145825-A1 USE OF OPIOID ANTAGONISTS THE UNIVERSITY OF CHICAGO 2021-05-20 US disclosed
EP-2278966-B1 TREATMENT WITH OPIOID ANTAGONISTS AND MTOR INHIBITORS UNIV CHICAGO (US) 2019-10-09 EP disclosed
US-10383869-B2 Treatment with opioid antagonists and mTOR inhibitors THE UNIVERSITY OF CHICAGO (US) 2019-08-20 US disclosed
US-20180098947-A1 PARTICLES CONTAINING AN OPIOID RECEPTOR ANTAGONIST AND METHODS OF USE THE UNIVERSITY OF CHICAGO 2018-04-12 US disclosed
US-20180008594-A1 USE OF OPIOID ANTAGONISTS THE UNIVERSTIY OF CHICAGO 2018-01-11 US disclosed
US-20170258909-A1 USE OF OPIOID ANTAGONISTS TO ATTENUATE ENDOTHELIAL CELL PROLIFERATION AND MIGRATION THE UNIVERSITY OF CHICAGO 2017-09-14 US disclosed
WO-2005056011-A1 METHODS OF PREVENTING AND TREATING NON-OPIOID INDUCED GASTROINTESTINAL DYSFUNCTION ADOLOR CORPORATION (US) 2005-06-23 WO disclosed
US-20050124657-A1 Administering aryl piperidine compound before surgery to treat gastrointestinal disorders and to relieve stress associated with surgery MERCK SHARP & DOHME LLC 2005-06-09 US disclosed
EP-0657428-B1 Preparation of 3,4,4-trisubstitutedpiperidinyl-n-alkylcarboxylates and intermediates, useful as opioid antagonists LILLY CO ELI (US) 2001-04-04 EP disclosed
EP-0984004-A2 Trisubstituted-piperidinyl-N-alkylcarboxylates as opioid antagonists ELI LILLY AND COMPANY (US) 2000-03-08 EP disclosed
US-5434171-A Gastrointestinal disorders; alvimopan ELI LILLY AND COMPANY (US) 1995-07-18 US disclosed
EP-0657428-A1 Preparation of 3,4,4-trisubstitutedpiperidinyl-n-alkylcarboxylates and intermediates, useful as opioid antagonists ELI LILLY AND COMPANY (US) 1995-06-14 EP 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 (9 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-10383869-B2 Treatment with opioid antagonists and mTOR inhibitors OPRL1, OPRK1, OPRM1 OPRM1 3/4885OPRD1 4/4885OPRK1 2/4885
US-20060211733-A1 Methods of preventing and treating opioid bowel dysfunction OPRK1, SLC10A2, SI OPRM1 5/4885OPRD1 4/4885OPRK1 1/4885
US-20180098947-A1 PARTICLES CONTAINING AN OPIOID RECEPTOR ANTAGONIST AND METHODS OF USE OPRM1, OPRK1, OGFR OPRM1 1/4885OPRD1 4/4885OPRK1 2/4885
US-20150126554-A1 METHODS OF PREVENTING AND TREATING GASTROINTESTINAL DYSFUNCTION VIP, FABP2, SI OPRM1 401/4885OPRD1 128/4885OPRK1 135/4885
US-20210145825-A1 USE OF OPIOID ANTAGONISTS OGFR, OPRL1, OPRK1 OPRM1 4/4885OPRD1 5/4885OPRK1 3/4885
US-20050124657-A1 Administering aryl piperidine compound before surgery to treat gastrointestinal disorders and to relieve stress associated with surgery PNMT, VIP, PREP OPRM1 70/4885OPRD1 5/4885OPRK1 9/4885
US-20050148630-A1 Methods of preventing and treating non-opioid induced gastrointestinal dysfunction SLC10A2, OPRK1, FABP2 OPRM1 7/4885OPRD1 4/4885OPRK1 2/4885
US-20170258909-A1 USE OF OPIOID ANTAGONISTS TO ATTENUATE ENDOTHELIAL CELL PROLIFERATION AND MIGRATION OGFR, OPRK1, OPRL1 OPRM1 4/4885OPRD1 5/4885OPRK1 2/4885
US-20180008594-A1 USE OF OPIOID ANTAGONISTS OGFR, OPRL1, OPRK1 OPRM1 4/4885OPRD1 5/4885OPRK1 3/4885

“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.