⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29428422 | 1.00 | — | — | |
| Hydrochloric Acid SCHEMBL826783 | 0.97 | TDP1 (0.94) | — | |
| Hydrochloric Acid SCHEMBL28219263 | 0.97 | TDP1 (0.94) | — | |
| Hydrochloric Acid SCHEMBL29467723 | 0.94 | TDP1 (0.89) | — | |
| SCHEMBL22717088 | 0.92 | TDP1 (0.84) | — | |
| Butane SCHEMBL21068442 | 0.89 | TDP1 (0.80) | — | |
| Sulfur Dioxide SCHEMBL28455461 | 0.89 | TDP1 (0.80) | — | |
| Sulfuric Acid SCHEMBL209880 | 0.85 | ALOX15 (0.73) | — | |
| Silver SCHEMBL29145999 | 0.83 | CYP3A4 (0.70) | — | |
| Diethylamine SCHEMBL27814636 | 0.83 | TDP1 (0.70) | — |
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
Appears in 6589 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2026106553-A1 | METHOD OF PREPARING A CARBON HYBRID NANOMATERIAL AND USES THEREOF | NANYANG TECHNOLOGICAL UNIVERSITY (SG) | 2026-05-21 | — | — | WO | claimed |
| US-12622856-B2 | Agent for oxidative dyeing of keratin fibers, containing isatin and at least one defined polymer | HENKEL AG & CO. KGAA (DE) | 2026-05-12 | — | — | US | claimed |
| WO-2025242864-A1 | DISCOLORING COMPOSITION FOR KERATIN FIBERS DYED WITH BLEACH-STABLE DIRECT DYES | KAO CORPORATION (JP) | 2025-11-27 | — | — | WO | claimed |
| EP-4634255-A1 | POLYURETHANE FOAM-FORMING REACTION MIXTURES, POLYURETHANE FOAMS FORMED THEREFROM, AND METHODS FOR THEIR PRODUCTION AND USE | Covestro LLC (US) | 2025-10-22 | — | — | EP | claimed |
| CN-120079371-A | Oxygen vacancy-containing tungsten trioxide catalyst and preparation method and application thereof | 南京理工大学 | 2025-06-03 | — | — | CN | claimed |
| CN-119955635-A | Yeast strain for synthesizing 2-methylbenzimidazole compound and application thereof | 茅台学院 | 2025-05-09 | — | — | CN | claimed |
| CN-119823364-A | Schiff base catalyst for epoxide and carbon disulfide copolymerization reaction | 四川大学 | 2025-04-15 | — | — | CN | claimed |
| WO-2025061319-A2 | IMPROVING THE WASHING FASTNESS OF LEVEL 2 COLORATIONS BY MEANS OF A SEALING PROCESS USING SILANES | HENKEL AG & CO. KGAA (DE) | 2025-03-27 | — | — | WO | claimed |
| US-20250075147-A1 | FRAGRANCE AND FLAVOR COMPOSITIONS COMPRISING NEW FLAVOR AND FRAGRANCE INGREDIENTS | OSMO LABS, PBC | 2025-03-06 | — | — | US | claimed |
| CN-119534746-A | Method for measuring amine value of amino polyether | 红宝丽集团股份有限公司 | 2025-02-28 | — | — | CN | claimed |
| US-4158660-A | Process for producing a purified 3,4-toluenediamine product and a mixture of 4- and 5-methylbenzotriazoles from a mixture of ortho-toluenediamine isomers | OLIN CORPORATION (US) | 1979-06-19 | — | — | US | claimed |
| US-4150208-A | CATALYST COMPLEX OF CHROMIUM CARBOXYLATE AND ORGANONITROGEN COMPOUND | CHEMPLEX COMPANY (US) | 1979-04-17 | — | — | US | claimed |
| US-4129414-A | Oxidation hair colorants containing water-soluble polyhalogen 3-aminophenols as couplers | HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (HENKEL KGAA) (DE) | 1978-12-12 | — | — | US | claimed |
| US-4119399-A | AQUEOUS, ALKALINE | CLAIROL INCORPORATED (US) | 1978-10-10 | — | — | US | claimed |
| US-4096093-A | REACTION PRODUCT OF A CHROMIUM CARBOXYLATE WITH AN ORGANIC NITROGEN COMPOUND | CHEMPLEX COMPANY (US) | 1978-06-20 | — | — | US | claimed |
| US-4092102-A | HAIR DYES, OXIDATION DYES | CLAIROL INCORPORATED (US) | 1978-05-30 | — | — | US | claimed |
| US-3981677-A | Oxidative hair dye compositions containing N-substituted o-phenylenediamines and method for their use | CLAIROL INCORPORATED (US) | 1976-09-21 | — | — | US | claimed |
| US-3970423-A | PHENYLENEDIAMINE DERIVATIVES | CLAIROL INCORPORATED (US) | 1976-07-20 | — | — | US | claimed |
| US-3960963-A | Separation of 3,4-diaminotoluene from a mixture of o-toluenediamine isomers | OLIN CORPORATION (US) | 1976-06-01 | — | — | US | claimed |
| US-3933847-A | DYES; REACTING A DIAMINE WITH SULFURIC ACID; ALKYLATION | SUMITOMO CHEMICAL COMPANY, LIMITED (JA) | 1976-01-20 | — | — | US | claimed |