⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18860866 | 0.98 | — | — | |
| SCHEMBL2146221 | 0.98 | — | — | |
| SCHEMBL28534031 | 0.96 | — | — | |
| SCHEMBL187597 | 0.96 | — | — | |
| SCHEMBL5855479 | 0.92 | — | — | |
| SCHEMBL28875133 | 0.91 | — | — | |
| SCHEMBL532996 | 0.91 | — | — | |
| SCHEMBL825424 | 0.91 | — | — | |
| SCHEMBL20507093 | 0.91 | — | — | |
| SCHEMBL8007471 | 0.89 | NAAA (0.41) | — |
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 7257 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-2025228982-A1 | PROCESS FOR RECYCLING A COMPOSITION COMPRISING A POLY(UREA-URETHANE) POLYMER WITH HINDERED UREA BONDS | BASF SE (DE) | 2025-11-06 | — | — | WO | claimed |
| WO-2025228991-A1 | RECYCLABLE POLY(UREA-URETHANE) SYSTEM | BASF SE (DE) | 2025-11-06 | — | — | WO | claimed |
| EP-4638541-A1 | RECYCLABLE POLY(UREA-URETHANE) POLYMER AND COMPOSITE WITH DYNAMIC HINDERED UREA BONDS (HUBS) | BASF SE (DE) | 2025-10-29 | — | — | EP | claimed |
| CN-119350190-A | Preparation method of polyisocyanate with adjustable viscosity | 山东新和成精化科技有限公司 | 2025-01-24 | — | — | CN | claimed |
| CN-119019289-A | Method for reducing acidity of isocyanate and adsorbent used in method | 山东新和成精化科技有限公司 | 2024-11-26 | — | — | CN | claimed |
| US-20240317679-A1 | METHOD FOR PREPARING ISOCYANATE COMPOUND | Hanwha Solutions Corporation (KR) | 2024-09-26 | — | — | US | claimed |
| US-20240317678-A1 | METHOD FOR PREPARING ISOCYANATE COMPOUND | Hanwha Solutions Corporation (KR) | 2024-09-26 | — | — | US | claimed |
| CN-118599063-A | Dual-image orthogonal storage material and preparation method and application thereof | 华中科技大学 | 2024-09-06 | — | — | CN | claimed |
| CN-117658530-B | Processing technology of environment-friendly anti-cracking color recycled asphalt concrete | 淮南市中岩新型建材有限公司 | 2024-09-03 | — | — | CN | claimed |
| CN-118384673-A | Post-treatment method and post-treatment system for preparing isocyanate by gas phase method | 山东新和成精化科技有限公司 | 2024-07-26 | — | — | CN | claimed |
| US-6180175-B1 | NOVEL ORGANIC SOLVENT TYPE, (A)VINYL TYPE POLYMER HAVING BOTH HYDROXYL GROUPS AND ALKOXYSILYL GROUPS, (B) A POLYOL COMPOUND, (C) A POLYISOCYANATE COMPOUND (D) A SILANOL GROUP FORMING CATALYST,URETHANIZATION REACTION OF A HYDROXYL GROUP AND AN | KANSAI PAINT CO., LTD. (JP) | 2001-01-30 | — | — | US | claimed |
| EP-1046637-A2 | Process for the reduction of chlorine content of low molecular weight isocyanates | BAYER AG (DE) | 2000-10-25 | — | — | EP | claimed |
| EP-1046636-A2 | Process for the reduction of chlorine content of organic isocyanates | BAYER AG (DE) | 2000-10-25 | — | — | EP | claimed |
| US-6100326-A | HOMOGENEOUSLY DISPERSING 4-ISOCYANATOMETHYLOCTANE 1,8-DIISOCYANATE IN WATER WITHOUT A HYDROPHILIC AGENT FOR FORMING A SOLVENT-FREE LACQUERS AND COATING AGENTS | BAYER AKTIENGESELLSCHAFT (DE) | 2000-08-08 | — | — | US | claimed |
| EP-0928799-A1 | Use of special isocyanates for the production of aqueous PUR coatings | BAYER AG (DE) | 1999-07-14 | — | — | EP | claimed |
| EP-0915115-A1 | Non-crystalline, ethylenically unsaturated polyurethanes | Bayer Corporation (US) | 1999-05-12 | — | — | EP | claimed |
| US-5854301-A | Non-crystalline, ethylenically unsaturated polyurethanes | ALLNEX IP S.À.R.L. (LU) | 1998-12-29 | — | — | US | claimed |
| EP-0825216-A2 | Low viscosity polyisocyanates prepared from monomeric triisocyanates | Bayer Corporation (US) | 1998-02-25 | — | — | EP | claimed |
| US-5714564-A | AN ISOCYANURATE TRIMER OF 4-ISOCYANATOMETHYL-1,8-OCTAMETHYLENE DIISOCYANATE; POLYURETHANE COATINGS; FAST DRYING; ADHESION TO METAL; HEAT AND WEAR RESISTANCE | BAYER CORPORATION (US) | 1998-02-03 | — | — | US | claimed |
| US-5206331-A | Sealant composition comprising moisture curable isocyanurate containing compound | SUNSTAR ENGINEERING, INC. (JP) | 1993-04-27 | — | — | US | claimed |