⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1395514 | 0.93 | EPHX1 (0.71) | — | |
| SCHEMBL7749273 | 0.91 | EPHX1 (0.75) | — | |
| SCHEMBL14643386 | 0.91 | EPHX1 (0.75) | — | |
| SCHEMBL9811711 | 0.91 | EPHX1 (0.75) | — | |
| SCHEMBL18641844 | 0.91 | EPHX1 (0.75) | — | |
| SCHEMBL7749192 | 0.91 | EPHX1 (0.75) | — | |
| SCHEMBL6278791 | 0.85 | — | — | |
| SCHEMBL19593402 | 0.85 | EPHX1 (0.50) | — | |
| SCHEMBL320112 | 0.85 | EPHX1 (0.85) | — | |
| SCHEMBL3139577 | 0.82 | EPHX1 (0.54) | — |
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 17 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3565808-A1 | COMPOUNDS USEFUL FOR TREATING GASTROINTESTINAL TRACT DISORDERS | Ardelyx, Inc. (US) | 2019-11-13 | — | — | EP | claimed |
| WO-2018129552-A1 | COMPOUNDS USEFUL FOR TREATING GASTROINTESTINAL TRACT DISORDERS | ARDELYX, INC. (US) | 2018-07-12 | — | — | WO | claimed |
| EP-3390382-B1 | SUBSTITUTED 4-PHENYL PYRIDINE COMPOUNDS AS NON-SYSTEMIC TGR5 AGONISTS | ARDELYX INC (US) | 2021-12-01 | — | — | EP | disclosed |
| EP-3565808-A1 | COMPOUNDS USEFUL FOR TREATING GASTROINTESTINAL TRACT DISORDERS | Ardelyx, Inc. (US) | 2019-11-13 | — | — | EP | disclosed |
| WO-2018129552-A1 | COMPOUNDS USEFUL FOR TREATING GASTROINTESTINAL TRACT DISORDERS | ARDELYX, INC. (US) | 2018-07-12 | — | — | WO | disclosed |
| CN-102046601-B | Benzene or thiophene derivative and use thereof as VAP-1 inhibitor | R TECH UENO LTD | 2014-08-27 | — | — | CN | disclosed |
| CN-102083825-B | FXA inhibitors with cyclic amidoxime or cyclic amidrazone as P4 subunit, processes for their preparations, and pharmaceutical compositions and derivatives thereof | LEGOCHEM BIOSCIENCE LTD | 2014-07-30 | — | — | CN | disclosed |
| CN-101448822-B | Substituted pyrazolopyrimidines | CEPHALON INC | 2013-11-06 | — | — | CN | disclosed |
| EP-0802195-B1 | Substituted 2,3-benzodiazepine derivatives, process and intermediates for their preparation and pharmaceutical compositions comprising them as well as their use | EGYT GYOGYSZERVEGYESZETI GYAR (HU) | 2003-11-19 | — | — | EP | disclosed |
| CN-1067685-C | Pyridazinoquinoline compounds | ZENECA LTD (GB) | 2001-06-27 | — | — | CN | disclosed |
| US-5807851-A | MUSCLE RELAXANTS; NERVOUS SYSTEM DISORDERS | EGIS GYOGYSZERGYAR RT. (HU) | 1998-09-15 | — | — | US | disclosed |
| EP-0802195-A2 | Substituted 2,3-benzodiazepine derivatives, process and intermediates for their preparation and pharmaceutical compositions comprising them as well as their use | EGIS GYOGYSZERGYAR RT. (HU) | 1997-10-22 | — | — | EP | disclosed |
| US-4546102-A | CARDIOTONIC AGENTS | BOEHRINGER INGELHEIM KG (DE) | 1985-10-08 | — | — | US | disclosed |
| EP-0108981-A1 | Semicarbazides, their preparation and use | BOEHRINGER INGELHEIM KG (DE) | 1984-05-23 | — | — | EP | disclosed |
| US-4069377-A | Polymerization of ethylenically unsaturated monomers employing secondary-aliphatic α-substituted azoalkanes | PENNWALT CORPORATION | 1978-01-17 | — | — | US | disclosed |
| US-4028344-A | FOAMING AGENTS, FREE RADICAL INITIATORS | PENNWALT CORPORATION (US) | 1977-06-07 | — | — | US | disclosed |
| US-4025502-A | POLYMERIZATION CATALYSTS, CURING AGENTS | PENNWALT CORPORATION (US) | 1977-05-24 | — | — | US | disclosed |