⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4165369 | 1.00 | — | — | |
| SCHEMBL4166272 | 1.00 | — | — | |
| SCHEMBL27686008 | 0.75 | — | — | |
| Isopropylbenzene SCHEMBL27920380 | 0.75 | TSHR (0.46) | — | |
| Isopropylbenzene SCHEMBL87809 | 0.73 | TAAR1 (0.50) | — | |
| SCHEMBL908216 | 0.73 | TAAR1 (0.50) | — | |
| Isopropylbenzene SCHEMBL6568 | 0.73 | — | — | |
| SCHEMBL7499823 | 0.73 | TAAR1 (0.50) | — | |
| SCHEMBL169730 | 0.73 | TAAR1 (0.50) | — | |
| Isopropylbenzene SCHEMBL8431863 | 0.73 | TAAR1 (0.50) | — |
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 25 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6130352-A | Method for producing (+) (2S,3S)-3-(2-aminophenylthio)-2-hydroxy-3(4'-methoxyphenyl)-propionic acid | COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) | 2000-10-10 | — | — | US | claimed |
| EP-0374647-B1 | Process for the preparation of optically active alpha-amino-acetals | BASF AG (DE) | 1994-06-15 | — | — | EP | claimed |
| US-20150065738-A1 | PHOSPHOROUS COMPOUND AND TRANSITION METAL COMPLEX THEREOF | TAKASAGO INTERNATIONAL CORPORATION (JP) | 2015-03-05 | — | — | US | disclosed |
| EP-2842959-A1 | Phosphorous compound and transition metal complex thereof | Takasago International Corporation (JP) | 2015-03-04 | — | — | EP | disclosed |
| EP-1979308-A1 | OPTICAL ISOMERS OF DIHYDRO-2,3-BENZODIAZEPINES AND THEIR STEREOSELECTIVE SYNTHESIS | EGIS Gyógyszergyár Nyrt (HU) | 2008-10-15 | — | — | EP | disclosed |
| US-20080036373-A1 | Platinum complex and light-emitting device | TAKASAGO INTERNATIONAL CORPORATION | 2008-02-14 | — | — | US | disclosed |
| WO-2007077469-A1 | OPTICAL ISOMERS OF DIHYDRO-2,3-BENZODIAZEPINES AND THEIR STEREOSELECTIVE SYNTHESIS | EGIS GYÓGYSZERGYÁR (HU) | 2007-07-12 | — | — | WO | disclosed |
| US-20060202197-A1 | Platinum complex and light-emitting device | TAKASAGO INTERNATIONAL CORPORATION | 2006-09-14 | — | — | US | disclosed |
| CN-1062555-C | Substituted benzyloxy carbonyl guanidine, its prepn. method, and application of the same as medicament and medicament containing the same | HOECHST AG (DE) | 2001-02-28 | — | — | CN | disclosed |
| US-6130352-A | Method for producing (+) (2S,3S)-3-(2-aminophenylthio)-2-hydroxy-3(4'-methoxyphenyl)-propionic acid | COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) | 2000-10-10 | — | — | US | disclosed |
| EP-0748795-B1 | Substituted benzyloxycarbonyl guanidines as Na+/H+ exchange inhibitors, process for their preparation, their use as medicinal or diagnostic agents as well as medicament containing them | HOECHST AG (DE) | 2000-08-23 | — | — | EP | disclosed |
| WO-1991013865-A1 | ANTIARRHYTHMIC AGENTS | ISIS INNOVATION LIMITED (GB) | 1991-09-19 | — | — | WO | disclosed |
| EP-0425976-A2 | Cycloalkylidene dye-stuffs | BASF Aktiengesellschaft (DE) | 1991-05-08 | — | — | EP | disclosed |
| EP-0374647-A2 | Process for the preparation of optically active alpha-amino-acetals | BASF Aktiengesellschaft (DE) | 1990-06-27 | — | — | EP | disclosed |
| EP-0196005-B1 | PYRIDAZINONES, THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | Dr. Karl Thomae GmbH (DE) | 1989-12-20 | — | — | EP | disclosed |
| EP-0196005-A1 | Pyridazinones, their preparation and pharmaceutical compositions containing them | Dr. Karl Thomae GmbH (DE) | 1986-10-01 | — | — | EP | disclosed |
| EP-0058341-B1 | AZEPINE DERIVATIVES, THEIR PREPARATION AND MEDICAMENTS CONTAINING THEM | Dr. Karl Thomae GmbH (DE) | 1985-05-15 | — | — | EP | disclosed |
| US-4414225-A | Azepine derivatives and their anti-thrombotic compositions and methods | DR. KARL THOMAE GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1983-11-08 | — | — | US | disclosed |
| EP-0058341-A1 | Azepine derivatives, their preparation and medicaments containing them | Dr. Karl Thomae GmbH (DE) | 1982-08-25 | — | — | EP | disclosed |
| US-4321063-A | Motor fuel | PHILLIPS PETROLEUM COMPANY (US) | 1982-03-23 | — | — | US | disclosed |