⚠ 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 | |
|---|---|---|---|---|
| Ammonia Solution, Strong SCHEMBL8329103 | 0.96 | TSHR (0.31) | — | |
| Water SCHEMBL28134902 | 0.96 | — | — | |
| Hydrazine SCHEMBL22444460 | 0.92 | — | — | |
| Ethylene SCHEMBL22362389 | 0.92 | — | — | |
| SCHEMBL17157573 | 0.89 | — | — | |
| SCHEMBL5620015 | 0.89 | — | — | |
| SCHEMBL7891835 | 0.89 | — | — | |
| SCHEMBL4342875 | 0.89 | MIF (0.32) | — | |
| Cyclohexane SCHEMBL9716720 | 0.89 | ALDH1A1 (0.35) | — | |
| Benzene SCHEMBL18493676 | 0.89 | — | — |
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 24744 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 |
|---|---|---|---|---|---|---|---|
| EP-4747293-A1 | OPTICAL MATERIAL DERIVED FROM A POLYMERIZABLE COMPOSITION CONTAINING A TERMINAL DIALKYNE COMPOUND | ESSILOR INTERNATIONAL (FR) | 2026-05-27 | — | — | EP | claimed |
| EP-4747295-A1 | OPTICAL MATERIAL DERIVED FROM A PREPOLYMER OBTAINED FROM A HETERODIFUNCTIONAL ALKYNE COMPOUND | ESSILOR INTERNATIONAL (FR) | 2026-05-27 | — | — | EP | claimed |
| EP-4747294-A1 | OPTICAL MATERIAL DERIVED FROM A POLYMERIZABLE COMPOSITION CONTAINING A HETERODIFUNCTIONAL ALKYNE COMPOUND | Essilor International (FR) | 2026-05-27 | — | — | EP | claimed |
| CN-121471864-B | Ultraviolet light curing adhesive composition for bonding optical composite film and preparation method thereof | 上海绘兰材料科技有限公司 | 2026-05-15 | — | — | CN | claimed |
| CN-122011330-A | Micro-crosslinking polyurea polyurethane, application method and product thereof | 李宁体育科技(北京)有限公司 | 2026-05-12 | — | — | CN | claimed |
| US-20260117015-A1 | METHOD OF CURING A POLYTHIOURETHANE BASED SUBSTRATE WITH A SALT CATALYST | ESSILOR INT (FR) | 2026-04-30 | — | — | US | claimed |
| EP-4720199-A1 | SELF-CROSSLINKABLE URETHANE (METH)ACRYLATES | ARKEMA France (FR) | 2026-04-08 | — | — | EP | claimed |
| US-20260092174-A1 | COMPOSITION FOR FORMING ECO-FRIENDLY POLYURETHANE FOAM HAVING IMPROVED INSULATION PROPERTIES AND METHOD FOR PREPARING POLYURETHANE FOAM | SAMYANG CORPORATION (KR) | 2026-04-02 | — | — | US | claimed |
| EP-3643732-B1 | COMPOSITION FOR FORMING ENVIRONMENTALLY FRIENDLY POLYURETHANE FOAM AND METHOD FOR MANUFACTURING POLYURETHANE FOAM | SAMYANG CORP (KR) | 2026-04-01 | — | — | EP | claimed |
| US-20260090364-A1 | METHOD OF MANUFACTURING SACRIFICIAL LAYER AND METHOD OF MANUFACTURING SEMICONDUCTOR DEVICE BY USING THE SAME | SAMSUNG ELECTRONICS CO., LTD. (KR) | 2026-03-26 | — | — | US | claimed |
| US-4261881-A | PREVENTION OF DEPOLYMERIZATION DURING MELT SPINNING BY INCORPORATION OF AN ISOCYANATE | CHEVRON RESEARCH COMPANY (US) | 1981-04-14 | — | — | US | claimed |
| US-4245067-A | EASILY HANDLED AND CURED AT NORMAL TEMPERATURE | HITACHI CHEMICAL COMPANY, LTD. (JP) | 1981-01-13 | — | — | US | claimed |
| EP-0010355-A1 | Photo-hardenable composition, method of bonding materials therewith and laminates obtained | DELTAGLASS S.A. (CH) | 1980-04-30 | — | — | EP | claimed |
| US-4193832-A | DISPERSIONS OF POLYMERS CONTAINING ISOCYANATE-REACTIVE HYDROGEN ATOMS IN POLYHYDROXYL COMPOUNDS | BAYER AKTIENGESELLSCHAFT (DE) | 1980-03-18 | — | — | US | claimed |
| US-4186119-A | Polyurethanes prepared from alcohols and hydrocarbon polyisocyanates used in textile wet treatment processes | SANDOZ LTD. (CH) | 1980-01-29 | — | — | US | claimed |
| US-RE29711-E | POLYOXYALKYLENE POLYOL ENDCAPPED WITH POLYISOCYANATES, POLYAMINE; TOUGH, ABRASION RESISTANT | W. R. GRACE & CO. (US) | 1978-07-25 | — | — | US | claimed |
| US-4100118-A | POLYGLYCIDYL ESTER OF A FATTY ACID, ISOCYANATE COMPOUND AND CURING CATALYST, THERMAL RESISTANCE, THERMAL SHOCK RESISTANCE | HITACHI, LTD. (JP) | 1978-07-11 | — | — | US | claimed |
| US-4058644-A | Sublimation transfer and method | STEPAN COMPANY, NORTHFIELD, IL 60093 A CORP. OF DE. | 1977-11-15 | — | — | US | claimed |
| US-3972846-A | Curable urethane resin composition comprising a mixture of polyisocyanate, active hydrogen compound and diketo compound | SUMITOMO CHEMICAL COMPANY, LIMITED (JA) | 1976-08-03 | — | — | US | claimed |
| US-3931117-A | Coating powders for protective films based on ε-caprolactam-blocked isocyanates | COOK PAINT AND VARNISH COMPANY (US) | 1976-01-06 | — | — | US | claimed |