⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28535614 | 0.97 | F2 (0.93) | — | |
| Hydrochloric Acid SCHEMBL4004566 | 0.97 | F2 (0.93) | — | |
| Hydrochloric Acid SCHEMBL5873177 | 0.97 | F2 (0.93) | — | |
| Hydrochloric Acid SCHEMBL16196292 | 0.97 | F2 (0.93) | — | |
| SCHEMBL24666733 | 0.88 | F2 (0.78) | — | |
| SCHEMBL16594580 | 0.88 | F2 (0.78) | — | |
| SCHEMBL16598321 | 0.88 | F2 (0.78) | — | |
| Bicarbonate SCHEMBL28715610 | 0.88 | F2 (0.78) | — | |
| Sulfuric Acid SCHEMBL209881 | 0.84 | F2 (0.70) | — | |
| Sulfuric Acid SCHEMBL8325165 | 0.84 | F2 (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 27608 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 |
|---|---|---|---|---|---|---|---|
| CN-119613216-B | Toluene purification treatment method and application thereof | Wanhua Chemical Group (Fujian) Isocyanate Co.,Ltd. (CN) | 2026-05-26 | — | — | CN | claimed |
| CN-117327267-B | Low-viscosity aniline polyether polyol and preparation method and application thereof | SHANDONG INOV NEW MATERIAL Co.,Ltd. (CN) | 2026-05-26 | — | — | CN | claimed |
| CN-121319307-B | Hard polyurethane foam material for high-temperature-resistant pipeline and preparation method thereof | SHANDONG INOV NEW MATERIAL Co.,Ltd. (CN) | 2026-05-26 | — | — | CN | claimed |
| WO-2026102602-A1 | COMPOSITION FOR DYEING KERATIN FIBERS | L'OREAL (FR) | 2026-05-21 | — | — | WO | claimed |
| CN-122060388-A | Bio-based aqueous single-component polyurethane waterproof coating and preparation method thereof | 万华化学集团股份有限公司 | 2026-05-19 | — | — | CN | claimed |
| CN-119331177-B | Modified polyurethane dispersoid and preparation method thereof | 万华化学集团股份有限公司 | 2026-05-19 | — | — | CN | claimed |
| CN-116874742-B | Curable epoxy resin composition and preparation method and application thereof | 万华化学集团股份有限公司 | 2026-05-19 | — | — | CN | claimed |
| CN-121249137-B | Intelligent grouting material and preparation method and application thereof | 山东大学 | 2026-05-15 | — | — | CN | claimed |
| CN-117447357-B | Preparation method of isocyanate | 万华化学集团股份有限公司 | 2026-05-15 | — | — | CN | claimed |
| CN-117406517-B | Wide spectrum stealth system based on electric drive | 中国科学院上海硅酸盐研究所 | 2026-05-12 | — | — | CN | claimed |
| US-4092102-A | HAIR DYES, OXIDATION DYES | CLAIROL INCORPORATED (US) | 1978-05-30 | — | — | US | claimed |
| US-4076577-A | Process for the separation of residues of toluenediisocyanate production | BASF WYANDOTTE CORPORATION (US) | 1978-02-28 | — | — | US | claimed |
| US-4039568-A | AMINE DECOMPOSITION ACCELERATOR | DAI-ICHI KOGYO SEIYAKU CO., LTD. (JA) | 1977-08-02 | — | — | US | claimed |
| US-4026944-A | TREATING DINITRONAPHTHALENE WITH HYDROGEN, HYDROGENATION CATALYST | BAYER AKTIENGESELLSCHAFT (DT) | 1977-05-31 | — | — | 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-3973900-A | AMINO NITRO BENZENES | WELLA AG (DT) | 1976-08-10 | — | — | 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-3931912-A | Two-part hair dye or hair bleach package | THE GILLETTE COMPANY (US) | 1976-01-13 | — | — | US | claimed |
| US-3931110-A | RAPID CURING ADHESIVE COMPOSITIONS COMPRISING THE REACTION PRODUCT OF A KETONE ALDEHYDE CONDENSATION POLYMER AND A PRIMARY AROMATIC AMINE | THE DOW CHEMICAL COMPANY (US) | 1976-01-06 | — | — | US | claimed |