⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29363854 | 1.00 | — | — | |
| Water SCHEMBL3857839 | 0.97 | CD44 (0.94) | — | |
| Hydrochloric Acid SCHEMBL300661 | 0.97 | CD44 (0.94) | — | |
| SCHEMBL28535612 | 0.97 | CD44 (0.94) | — | |
| Hydrogen Sulfide SCHEMBL28874707 | 0.97 | CD44 (0.94) | — | |
| Hydrochloric Acid SCHEMBL5033003 | 0.97 | CD44 (0.94) | — | |
| Hydrogen Peroxide SCHEMBL14358429 | 0.95 | CD44 (0.90) | — | |
| Ethylene SCHEMBL1827345 | 0.95 | CD44 (0.90) | — | |
| SCHEMBL20455007 | 0.92 | CD44 (0.85) | — | |
| SCHEMBL9782180 | 0.92 | CD44 (0.85) | — |
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 18354 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-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-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-117447357-B | Preparation method of isocyanate | 万华化学集团股份有限公司 | 2026-05-15 | — | — | CN | claimed |
| CN-122011321-A | Quick-release polyurethane composition, quick-release polyurethane sandwich panel, preparation method and production system thereof | 河北亚东化工集团有限公司 | 2026-05-12 | — | — | CN | claimed |
| US-12606692-B2 | Spectacle lens | HOYA LENS THAILAND LTD. (TH) | 2026-04-21 | — | — | US | claimed |
| EP-3458491-B1 | PROCESS FOR PREPARING POLYISOCYANURATE RIGID FOAMS | BASF SE (DE) | 2026-03-25 | — | — | EP | claimed |
| EP-4405327-B1 | OBTAINING ALIPHATIC AMINES FROM COMPOSITIONS | COVESTRO DEUTSCHLAND AG (DE) | 2026-03-18 | — | — | EP | claimed |
| US-12552894-B2 | Viscoelastic elastomeric polyurethane foams, process for preparing them and use thereof | BASF SE (DE) | 2026-02-17 | — | — | US | claimed |
| US-4137398-A | ADSORPTION ON MAGNESIUM SILICATES, TREATING WITH MAGNESIUM CARBONATE AND CARBON DIOXIDE, FILTRATION | BASF WYANDOTTE CORPORATION (US) | 1979-01-30 | — | — | US | claimed |
| US-4122035-A | Process for reclaiming synthetic magnesium silicate or aluminum silicate adsorbents employed in the purification of polyether polyols | BASF WYANDOTTE CORPORATION (US) | 1978-10-24 | — | — | US | claimed |
| US-4120913-A | MIXING LIQUID EPOXY RESIN AND AROMATIC AMINE AND SOLID EPOXY RESIN POWDER | WESTINGHOUSE ELECTRIC CORP. (US) | 1978-10-17 | — | — | US | claimed |
| US-4110266-A | Process for converting the decomposition products of polyurethane and novel compositions thereby obtained | MCDONNELL DOUGLAS CORPORATION (US) | 1978-08-29 | — | — | US | claimed |
| US-4096165-A | Method of manufacturing aromatic isocyanates | ALLIED CHEMICAL CORPORATION (US) | 1978-06-20 | — | — | US | claimed |
| US-4076577-A | Process for the separation of residues of toluenediisocyanate production | BASF WYANDOTTE CORPORATION (US) | 1978-02-28 | — | — | US | claimed |
| US-4076537-A | Light-sensitive materials containing organo tellurium or selenium compounds and sensitizers | FUJI PHOTO FILM CO., LTD. (JA) | 1978-02-28 | — | — | US | claimed |
| US-4026944-A | TREATING DINITRONAPHTHALENE WITH HYDROGEN, HYDROGENATION CATALYST | BAYER AKTIENGESELLSCHAFT (DT) | 1977-05-31 | — | — | 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-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 |