⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10516996 | 0.79 | ALDH1A1 (0.43) | — | |
| SCHEMBL6247502 | 0.73 | — | — | |
| SCHEMBL451030 | 0.69 | ALDH1A1 (0.47) | — | |
| Hydrochloric Acid SCHEMBL30419009 | 0.69 | ALDH1A1 (0.41) | — | |
| SCHEMBL1899890 | 0.64 | ALDH1A1 (0.43) | — | |
| SCHEMBL11364660 | 0.64 | — | — | |
| SCHEMBL786960 | 0.64 | ALDH1A1 (0.50) | — | |
| SCHEMBL11755153 | 0.64 | ALDH1A1 (0.43) | — | |
| SCHEMBL1796549 | 0.64 | ALDH1A1 (0.43) | — | |
| SCHEMBL9644038 | 0.64 | ALDH1A1 (0.43) | — |
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 61 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117024456-A | Condensed cyclic compound, material containing the same, and organic electroluminescent device | 中国科学院理化技术研究所 | 2023-11-10 | — | — | CN | claimed |
| CN-112390811-A | Dithia-anthrone derivative and preparation method and application thereof | 中国科学院理化技术研究所 | 2021-02-23 | — | — | CN | claimed |
| CN-110551054-A | maleimide derivative, and preparation method and application thereof | TECHNICAL INST PHYSICS & CHEMISTRY CAS | 2019-12-10 | — | — | CN | claimed |
| US-20180327396-A1 | NOVEL PYRIDINE DERIVATIVES | HOFFMANN-LA ROCHE INC. (US) | 2018-11-15 | — | — | US | claimed |
| EP-3126359-A1 | PYRIDINE-2-AMIDES USEFUL AS CB2 AGONISTS | F. Hoffmann-La Roche AG (CH) | 2017-02-08 | — | — | EP | claimed |
| US-20160376262-A1 | NOVEL PYRIDINE DERIVATIVES | HOFFMANN-LA ROCHE INC. (US) | 2016-12-29 | — | — | US | claimed |
| WO-2015150440-A1 | PYRIDINE-2-AMIDES USEFUL AS CB2 AGONISTS | F. HOFFMANN-LA ROCHE AG (CH) | 2015-10-08 | — | — | WO | claimed |
| US-20100234343-A1 | INHIBITORS OF ION CHANNELS | ICAGEN, INC. (US) | 2010-09-16 | — | — | US | claimed |
| US-7705158-B2 | Inhibitors of ion channels | ICAGEN, INC. (US) | 2010-04-27 | — | — | US | claimed |
| US-20020197223-A1 | ANILINE COMPOUND CONTAINING HAIR DYE COMPOSITION AND METHOD OF DYEING HAIR | FUJIFILM CORPORATION (JP) | 2002-12-26 | — | — | US | claimed |
| US-5290790-A | Histamine H3 antagonists, psychotropic action | NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (FR) | 1994-03-01 | — | — | US | claimed |
| US-4966968-A | 3-(1,1,4-TRIMETHYL-6-ISOPROPYL-5-INDANOYL)ACRYLIC AMIDES OR ESTERS; HERBICIDES | MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) | 1990-10-30 | — | — | US | claimed |
| US-4341551-A | HERBICIDES, FUNGICIDES, PLANT GROWTH REGULATORS | SCHERING AG (DE) | 1982-07-27 | — | — | US | claimed |
| EP-0034743-A1 | Benzoxazoles, their preparation and their use as medicines | Dr. Karl Thomae GmbH (DE) | 1981-09-02 | — | — | EP | claimed |
| US-3963480-A | Herbicidal pyrrole-2-carboxamides | STERLING DRUG INC. (US) | 1976-06-15 | — | — | US | claimed |
| CN-117024456-A | Condensed cyclic compound, material containing the same, and organic electroluminescent device | 中国科学院理化技术研究所 | 2023-11-10 | — | — | CN | disclosed |
| CN-112390811-B | Dithia-anthrone derivative and preparation method and application thereof | 中国科学院理化技术研究所 | 2022-03-04 | — | — | CN | disclosed |
| US-4341551-A | HERBICIDES, FUNGICIDES, PLANT GROWTH REGULATORS | SCHERING AG (DE) | 1982-07-27 | — | — | US | disclosed |
| EP-0034743-A1 | Benzoxazoles, their preparation and their use as medicines | Dr. Karl Thomae GmbH (DE) | 1981-09-02 | — | — | EP | disclosed |
| US-4256738-A | BACTERICIDES, PYRIMIDINYL, QUINAZOLINYL | BOEHRINGER INGELHEIM GMBH (DE) | 1981-03-17 | — | — | US | disclosed |