Alvimopan

Alvimopan

SCHEMBL1477341

C[C@H]1CN(C[C@H](Cc2ccccc2)C(=O)NCC(=O)O)CC[C@@]1(C)c1cccc(O)c1.O.O

nearest known ligand 0.98

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 0.98
OPRD1 P41143 14/20 0.98
OPRK1 P41145 11/20 0.98
KCNE1 P15382 1/20 0.98
KCNQ1 P51787 1/20 0.98
CACNA1C Q13936 1/20 0.98

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 SCHEMBL8785038 1.00 OPRM1 (0.98) OPRM1OPRD1OPRK1KCNE1KCNQ1
Alvimopan SCHEMBL5953843 1.00 OPRM1 (0.98) OPRM1OPRD1OPRK1KCNE1KCNQ1
Alvimopan SCHEMBL8786261 1.00 OPRM1 (0.98) OPRM1OPRD1OPRK1KCNE1KCNQ1
Alvimopan SCHEMBL14995531 0.99 OPRM1 (1.00) OPRM1OPRD1OPRK1KCNE1KCNQ1
Alvimopan SCHEMBL5953724 0.99 OPRM1 (1.00) OPRM1OPRD1OPRK1KCNE1KCNQ1
Alvimopan SCHEMBL25348849 0.99 OPRM1 (1.00) OPRM1OPRD1OPRK1KCNE1KCNQ1
Alvimopan SCHEMBL19367933 0.99 OPRM1 (1.00) OPRM1OPRD1OPRK1KCNE1KCNQ1
Alvimopan SCHEMBL19367975 0.99 OPRM1 (1.00) OPRM1OPRD1OPRK1KCNE1KCNQ1
Alvimopan SCHEMBL49578 0.99 OPRM1 (1.00) OPRM1OPRD1OPRK1KCNE1KCNQ1
Alvimopan SCHEMBL12188165 0.99 OPRM1 (1.00) 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 51 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2017158615-A1 AN IMPROVED PROCESS FOR THE PREPARATION OF [[2(S)-[[4(R)-(3-HYDROXY PHENYL)-3(R), 4-DIMETHYL-1 -PIPERIDINYL]METHYL]-1 -OXO-3-PHENYLPROPYL] AMINO]ACETIC ACID DIHYDRATE MSN LABORATORIES PRIVATE LIMITED (IN) 2017-09-21 WO claimed
US-20150150819-A1 COMPOSITIONS CONTAINING OPIOID ANTAGONISTS MERCK SHARP & DOHME CORP. 2015-06-04 US claimed
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-20070092576-A1 Micronizing with sugar excipient; stability and bioavailability; e.g. alvimopam; solid dosage forms ADOLOR CORPORATION (US) 2007-04-26 US claimed
US-20060211733-A1 Methods of preventing and treating opioid bowel dysfunction ADOLOR CORPORATION (US) 2006-09-21 US 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
WO-2024127407-A1 VIROPORINS BLOCKERS/INHIBITORS AS ANTI-INFLUENZA AGENTS YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERUSALEM LTD. (IL) 2024-06-20 WO disclosed
US-10093625-B2 Process for the preparation of [[2(S)-[[4(R)-(3-hydroxyphenyl)-3(R),4-dimethyl-1-piperidinyl]methyl]-1-oxo-3-phenylpropyl]amino]acetic acid dihydrate MSN LABORATORIES PRIVATE LIMITED (IN) 2018-10-09 US disclosed
US-10093625-B2 Process for the preparation of [[2(S)-[[4(R)-(3-hydroxyphenyl)-3(R),4-dimethyl-1-piperidinyl]methyl]-1-oxo-3-phenylpropyl]amino]acetic acid dihydrate MSN LABORATORIES PRIVATE LIMITED (IN) 2018-10-09 US disclosed
US-10093625-B2 Process for the preparation of [[2(S)-[[4(R)-(3-hydroxyphenyl)-3(R),4-dimethyl-1-piperidinyl]methyl]-1-oxo-3-phenylpropyl]amino]acetic acid dihydrate MSN LABORATORIES PRIVATE LIMITED (IN) 2018-10-09 US disclosed
WO-2017158615-A1 AN IMPROVED PROCESS FOR THE PREPARATION OF [[2(S)-[[4(R)-(3-HYDROXY PHENYL)-3(R), 4-DIMETHYL-1 -PIPERIDINYL]METHYL]-1 -OXO-3-PHENYLPROPYL] AMINO]ACETIC ACID DIHYDRATE MSN LABORATORIES PRIVATE LIMITED (IN) 2017-09-21 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 (7 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-20060211733-A1 Methods of preventing and treating opioid bowel dysfunction OPRK1, SLC10A2, SI OPRM1 5/4885OPRD1 4/4885OPRK1 1/4885
US-10093625-B2 Process for the preparation of [[2(S)-[[4(R)-(3-hydroxyphenyl)-3(R),4-dimethyl-1-piperidinyl]methyl]-1-oxo-3-phenylpropyl]amino]acetic acid dihydrate HPD, HCAR2, GRHPR OPRM1 549/4885OPRD1 318/4885OPRK1 483/4885
US-20150126554-A1 METHODS OF PREVENTING AND TREATING GASTROINTESTINAL DYSFUNCTION VIP, FABP2, SI OPRM1 401/4885OPRD1 128/4885OPRK1 135/4885
US-20070092576-A1 Micronizing with sugar excipient; stability and bioavailability; e.g. alvimopam; solid dosage forms OPRM1, OPRK1, OGFR OPRM1 1/4885OPRD1 5/4885OPRK1 2/4885
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-20150150819-A1 COMPOSITIONS CONTAINING OPIOID ANTAGONISTS OPRK1, OPRM1, OPRD1 OPRM1 2/4885OPRD1 3/4885OPRK1 1/4885
US-20050148630-A1 Methods of preventing and treating non-opioid induced gastrointestinal dysfunction SLC10A2, OPRK1, FABP2 OPRM1 7/4885OPRD1 4/4885OPRK1 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.