⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL21633313 | 1.00 | — | — | |
| SCHEMBL2338876 | 1.00 | — | — | |
| SCHEMBL15797071 | 1.00 | — | — | |
| SCHEMBL1746566 | 0.84 | AKR1B1 (0.36) | — | |
| SCHEMBL2338047 | 0.84 | AKR1B1 (0.36) | — | |
| SCHEMBL448041 | 0.84 | AKR1B1 (0.36) | — | |
| SCHEMBL7153437 | 0.84 | AKR1B1 (0.36) | — | |
| SCHEMBL17984934 | 0.84 | MPI (0.39) | — | |
| SCHEMBL14659599 | 0.82 | AKR1B1 (0.35) | — | |
| SCHEMBL16431695 | 0.82 | AKR1B1 (0.35) | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20220259249-A1 | INHIBITORS OF ANTIBIOTIC RESISTANCE MEDIATED BY ARNT | UNIVERSITÀ DEGLI STUDI DI ROMA "LA SAPIENZA" (IT) | 2022-08-18 | — | — | US | disclosed |
| EP-4003324-A1 | INHIBITORS OF ANTIBIOTIC RESISTANCE MEDIATED BY ARN T | Università degli Studi di Roma "La Sapienza" (IT) | 2022-06-01 | — | — | EP | disclosed |
| EP-3374027-B1 | RATIONAL DRUG DESIGN TARGETING RESISTANT GRAM-NEGATIVE BACTERIAL INFECTIONS TO POLYMYXIN-CLASS ANTIBIOTICS | UNIV COLUMBIA (US) | 2021-06-23 | — | — | EP | disclosed |
| US-10925857-B2 | Rational drug design targeting resistant gram-negative bacterial infections to polymyxin-class antibiotics | THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) | 2021-02-23 | — | — | US | disclosed |
| WO-2021014422-A1 | INHIBITORS OF ANTIBIOTIC RESISTANCE MEDIATED BY ARN T | UNIVERSITÀ DEGLI STUDI DI ROMA "LA SAPIENZA" (IT) | 2021-01-28 | — | — | WO | disclosed |
| US-20190231747-A1 | RATIONAL DRUG DESIGN TARGETING RESISTANT GRAM-NEGATIVE BACTERIAL INFECTIONS TO POLYMYXIN-CLASS ANTIBIOTICS | THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK | 2019-08-01 | — | — | US | disclosed |
| EP-3374027-A1 | RATIONAL DRUG DESIGN TARGETING RESISTANT GRAM-NEGATIVE BACTERIAL INFECTIONS TO POLYMYXIN-CLASS ANTIBIOTICS | The Trustees of Columbia University in the City of New York (US) | 2018-09-19 | — | — | EP | disclosed |
| WO-2017083859-A1 | RATIONAL DRUG DESIGN TARGETING RESISTANT GRAM-NEGATIVE BACTERIAL INFECTIONS TO POLYMYXIN-CLASS ANTIBIOTICS | THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) | 2017-05-18 | — | — | WO | disclosed |