⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18103118 | 1.00 | — | — | |
| SCHEMBL7309630 | 1.00 | — | — | |
| Hydrochloric Acid SCHEMBL7781988 | 0.97 | — | — | |
| Ammonia Solution, Strong SCHEMBL9538657 | 0.97 | — | — | |
| SCHEMBL18897588 | 0.94 | ALDH1A1 (0.40) | — | |
| SCHEMBL2486901 | 0.85 | — | — | |
| SCHEMBL23340759 | 0.84 | ALDH1A1 (0.38) | — | |
| SCHEMBL11332093 | 0.81 | ALDH1A1 (0.44) | — | |
| SCHEMBL22004592 | 0.80 | CACNA2D1 (0.37) | — | |
| SCHEMBL12793762 | 0.78 | ALDH1A1 (0.33) | — |
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 112 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117069595-A | 2-methyl-N, N-bis (4-methylpentane-2-yl) cyclohexane-1, 3-diamine and preparation method and application thereof | 山东阳谷华泰化工股份有限公司 | 2023-11-17 | — | — | CN | claimed |
| US-5490986-A | SYNTHETIC BLOOD | TEMPLE UNIVERSITY OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) | 1996-02-13 | — | — | US | claimed |
| US-5284663-A | Artificial blood substitute; Lewis acid-Lewis base salt with perfluorocarbon encapsulated therein | TEMPLE UNIVERSITY (US) | 1994-02-08 | — | — | US | claimed |
| WO-1993001806-A1 | ENCAPSULATED PERFLUOROCARBONS | TEMPLE UNIVERSITY OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) | 1993-02-04 | — | — | WO | claimed |
| WO-1990010051-A1 | FUEL COMPOSITION FOR CONTROL OF INTAKE VALVE DEPOSITS | UNION OIL COMPANY OF CALIFORNIA (US) | 1990-09-07 | — | — | WO | claimed |
| US-20240158356-A1 | DIAMINOPYRIMIDINES AS P2X3 AND P2X2/3 ANTAGONISTS | ROCHE PALO ALTO LLC (US) | 2024-05-16 | — | — | US | disclosed |
| EP-3820846-B1 | COMPOSITION FOR INHIBITING MONOMER POLYMERIZATION COMPRISING A NITROXIDE INHIBITOR, A QUINONE METHIDE RETARDER AND AN AMINE STABILIZER | ECOLAB USA INC (US) | 2024-01-03 | — | — | EP | disclosed |
| CN-117069595-A | 2-methyl-N, N-bis (4-methylpentane-2-yl) cyclohexane-1, 3-diamine and preparation method and application thereof | 山东阳谷华泰化工股份有限公司 | 2023-11-17 | — | — | CN | disclosed |
| CN-117069595-A | 2-methyl-N, N-bis (4-methylpentane-2-yl) cyclohexane-1, 3-diamine and preparation method and application thereof | 山东阳谷华泰化工股份有限公司 | 2023-11-17 | — | — | CN | disclosed |
| US-20230295457-A1 | SURFACE TREATMENT LIQUID AND SURFACE TREATMENT METHOD | TOKYO OHKA KOGYO CO., LTD. (JP) | 2023-09-21 | — | — | US | disclosed |
| US-20230100975-A1 | DIAMINOPYRIMIDINES AS P2X3 AND P2X2/3 ANTAGONISTS | ROCHE PALO ALTO LLC (US) | 2023-03-30 | — | — | US | disclosed |
| CN-114853846-A | Androgen receptor degradation agent and application thereof | 苏州国匡医药科技有限公司 | 2022-08-05 | — | — | CN | disclosed |
| US-5214209-A | Method of producing primary amines in high yields and novel intermediates therefor | ALDRICH CHEMICAL COMPANY, INC. (US) | 1993-05-25 | — | — | US | disclosed |
| US-5210310-A | Optically active dimethylorganoboranes | ALDRICH CHEMICAL CO., INC. (US) | 1993-05-11 | — | — | US | disclosed |
| WO-1993001806-A1 | ENCAPSULATED PERFLUOROCARBONS | TEMPLE UNIVERSITY OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) | 1993-02-04 | — | — | WO | disclosed |
| US-5087700-A | Method of producing primary amines in high yields | ALDRICH CHEMICAL COMPANY, INC. (US) | 1992-02-11 | — | — | US | disclosed |
| US-4918229-A | Method of producing primary amines in high yields and novel intermediates therefor | ALDRICH CHEMICAL COMPANY, INC. (US) | 1990-04-17 | — | — | US | disclosed |
| EP-0318464-A2 | Antitumor platinum complexes | Bristol-Myers Squibb Company (US) | 1989-05-31 | — | — | EP | disclosed |
| EP-0306605-A1 | Antitumor platinum complexes | Bristol-Myers Squibb Company (US) | 1989-03-15 | — | — | EP | disclosed |
| US-4450246-A | TERTIARY AMINE SALT | W. R. GRACE & CO. (US) | 1984-05-22 | — | — | US | disclosed |