Rifaximin

Rifaximin

SCHEMBL9397878

CO[C@H]1/C=C/O[C@@]2(C)Oc3c(C)c(O)c4c(O)c(c5c(nc6cc(C)ccn65)c4c3C2=O)NC(=O)/C(C)=C\C=C\[C@H](C)[C@H](O)[C@@H](C)[C@@H](O)[C@@H](C)[C@H](OC(C)=O)[C@@H]1C.CO[C@H]1/C=C/O[C@@]2(C)Oc3c(C)c(O)c4c(O)c(c5c(nc6cc(C)ccn65)c4c3C2=O)NC(=O)/C(C)=C\C=C\[C@H](C)[C@H](O)[C@@H](C)[C@@H](O)[C@@H](C)[C@H](OC(C)=O)[C@@H]1C

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

rpoArpoBrpoCrpoZ

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

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABCB11 O95342 5/20 1.00
ABCC4 O15439 4/20 1.00
ABCC2 Q92887 4/20 1.00
MAPT P10636 4/20 1.00
TBXA2R P21731 3/20 1.00
GAA P10253 3/20 1.00
MAPK1 P28482 3/20 1.00
ABCC3 O15438 3/20 1.00
NR1I2 O75469 2/20 1.00
ADRB2 P07550 2/20 1.00
ADRB1 P08588 2/20 1.00
ADORA3 P0DMS8 2/20 1.00
ADRA2B P18089 2/20 1.00
ADRA2C P18825 2/20 1.00
SLC6A2 P23975 2/20 1.00
NPY1R P25929 2/20 1.00
HTR2C P28335 2/20 1.00
ADORA2A P29274 2/20 1.00
BDKRB2 P30411 2/20 1.00
AVPR2 P30518 2/20 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
Rifaximin SCHEMBL16351426 1.00 ABCB11 (1.00) ABCB11ABCC4ABCC2MAPTTBXA2R
Rifaximin SCHEMBL124066 1.00 ABCB11 (1.00) ABCB11ABCC4ABCC2MAPTTBXA2R
Rifaximin SCHEMBL16229249 1.00 ABCB11 (1.00) ABCB11ABCC4ABCC2MAPTTBXA2R
Rifaximin SCHEMBL874028 1.00 ABCB11 (1.00) ABCB11ABCC4ABCC2MAPTTBXA2R
Rifaximin SCHEMBL14677545 1.00 ABCB11 (1.00) ABCB11ABCC4ABCC2MAPTTBXA2R
Rifaximin SCHEMBL13897021 1.00 ABCB11 (1.00) ABCB11ABCC4ABCC2MAPTTBXA2R
Rifaximin SCHEMBL23314507 1.00 ABCB11 (1.00) ABCB11ABCC4ABCC2MAPTTBXA2R
Rifaximin SCHEMBL17930616 1.00 ABCB11 (1.00) ABCB11ABCC4ABCC2MAPTTBXA2R
Rifaximin SCHEMBL124067 1.00 ABCB11 (1.00) ABCB11ABCC4ABCC2MAPTTBXA2R
Rifaximin SCHEMBL11956496 1.00 ABCB11 (1.00) ABCB11ABCC4ABCC2MAPTTBXA2R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3675838-A1 LYMPHATIC SYSTEM-DIRECTING LIPID PRODRUGS Puretecch LYT, Inc. (US) 2020-07-08 EP disclosed
WO-2019046491-A1 LYMPHATIC SYSTEM-DIRECTING LIPID PRODRUGS ARIYA THERAPEUTICS, INC. (US) 2019-03-07 WO disclosed
EP-2870163-B1 PHARMACEUTICAL COMPOSITIONS COMPRISING RIFAXIMIN AND AMINO ACIDS, PREPARATION METHOD AND USE THEREOF ALFASIGMA SPA (IT) 2018-09-19 EP disclosed
US-20170189385-A1 PHARMACEUTICAL COMPOSITIONS COMPRISING RIFAXIMIN AND AMINO ACIDS, PREPARATION METHODS AND USE THEREOF ALFA WASSERMANN S.P.A. (IT) 2017-07-06 US disclosed
EP-3160467-A1 METHODS FOR RETREATING IRRITABLE BOWEL SYNDROME (IBS) Salix Pharmaceuticals, Inc. (US) 2017-05-03 EP disclosed
EP-3143027-A1 NEW SOLVATED CRYSTAL FORM OF RIFAXIMIN, PRODUCTION, COMPOSITIONS AND USES THEREOF ALFA WASSERMANN S.p.A. (IT) 2017-03-22 EP disclosed
EP-3127909-A1 CRYSTALLINE FORMS OF RIFAXIMIN AND THEIR PREPARATION IN THE PRESENCE OF AMINO ACIDS ALFA WASSERMANN S.p.A. (IT) 2017-02-08 EP disclosed
US-9452157-B2 Pharmaceutical compositions comprising rifaximin and amino acids, preparation methods and use thereof ALFA WASSERMANN S.P.A (IT) 2016-09-27 US disclosed
WO-2016003536-A1 METHODS FOR RETREATING IRRITABLE BOWEL SYNDROME (IBS) SALIX PHARMACEUTICALS, INC. (US) 2016-01-07 WO disclosed
WO-2015173697-A1 NEW SOLVATED CRYSTAL FORM OF RIFAXIMIN, PRODUCTION, COMPOSITIONS AND USES THEREOF ALFA WASSERMANN S.P.A. (IT) 2015-11-19 WO disclosed
US-20140079783-A1 Pharmaceutical Compositions Comprising Rifaximin and Amino acids, Preparation Methods and Use Thereof ALFASIGMA S.P.A. (IT) 2014-03-20 US disclosed
CN-103118666-A Pharmaceutical formulations containing rifaximin, processes for their obtainment and method of treating intestinal disease ALFA WASSERMANN SPA 2013-05-22 CN disclosed
US-5352679-A OraL administering ALFA WASSERMANN S.P.A. (IT) 1994-10-04 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-20140079783-A1 Pharmaceutical Compositions Comprising Rifaximin and Amino acids, Preparation Methods and Use Thereof RIF1, MLX, SFXN1 ABCB11 214/4885ABCC4 3546/4885ABCC2 3083/4885
US-20170189385-A1 PHARMACEUTICAL COMPOSITIONS COMPRISING RIFAXIMIN AND AMINO ACIDS, PREPARATION METHODS AND USE THEREOF RIF1, MLX, SFXN1 ABCB11 214/4885ABCC4 3546/4885ABCC2 3083/4885

“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.