⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11388759 | 0.96 | NAAA (0.30) | — | |
| SCHEMBL21519847 | 0.96 | NAAA (0.30) | — | |
| SCHEMBL28653046 | 0.93 | FFAR1 (0.31) | — | |
| SCHEMBL28452545 | 0.91 | FFAR1 (0.34) | — | |
| SCHEMBL8003212 | 0.88 | — | — | |
| SCHEMBL28956942 | 0.84 | — | — | |
| SCHEMBL16300039 | 0.82 | — | — | |
| SCHEMBL7029276 | 0.81 | — | — | |
| SCHEMBL3904826 | 0.80 | TSHR (0.32) | — | |
| SCHEMBL7029272 | 0.79 | — | — |
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 3457 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-122095001-A | Blocked isocyanate prepolymer system and preparation method and application thereof | — | 2026-05-26 | — | — | CN | claimed |
| CN-122094997-A | Aqueous polyurethane coatings for printing applications | — | 2026-05-26 | — | — | CN | claimed |
| EP-4739721-A1 | A SOLVENT-FREE POLYURETHANE DISPERSION BASED ON POLYTRIMETHYLENE ETHER GLYCOL | Covestro Deutschland AG (DE) | 2026-05-13 | — | — | EP | claimed |
| US-12570864-B2 | Storage-stable pigmented formulations containing isocyanate groups and use thereof | COVESTRO DEUTSCHLAND AG (DE) | 2026-03-10 | — | — | US | claimed |
| US-12509419-B2 | Process for the distillation of isocyanates | COVESTRO DEUTSCHLAND AG (DE) | 2025-12-30 | — | — | US | claimed |
| EP-3931234-B1 | STORAGE STABLE PIGMENTED ISOCYANATE GROUP-CONTAINING FORMULATIONS COMPRISING ISOCYANATE GROUP-CONTAINING RUBBING RESIN AND THEIR USE | COVESTRO DEUTSCHLAND AG (DE) | 2025-10-15 | — | — | EP | claimed |
| WO-2025108919-A1 | BLOCKED ISOCYANATE PREPOLYMER SYSTEM, METHOD FOR PREPARING THE SAME, AND APPLICATION THEREOF | COVESTRO DEUTSCHLAND AG (DE) | 2025-05-30 | — | — | WO | claimed |
| CN-120025523-A | Blocked isocyanate prepolymer system and preparation method and application thereof | 科思创德国股份有限公司 | 2025-05-23 | — | — | CN | claimed |
| CN-114286837-B | Method for decomposing polyether polyurethane | 科思创德国股份有限公司 | 2025-05-20 | — | — | CN | claimed |
| WO-2025088050-A1 | WATERBORNE POLYURETHANE COATING FOR PRINTING APPLICATIONS | COVESTRO DEUTSCHLAND AG (DE) | 2025-05-01 | — | — | WO | claimed |
| US-20040133035-A1 | Elimination-free powder coating crosslinking agents | BAYER AKTIENGESELLSCHAFT (DE) | 2004-07-08 | — | — | US | claimed |
| US-5998510-A | POLYESTERURETHANE COPOLYMER | PREMIX, INC. (US) | 1999-12-07 | — | — | US | claimed |
| EP-0836630-A2 | AQUEOUS ADHESIVE COMPOSITIONS | LORD CORPORATION (US) | 1998-04-22 | — | — | EP | claimed |
| US-5717031-A | VULCANIZED ELASTOMERIC RUBBER PORTION CONSISTS OF SUBSTRATE, VULCANIZABLE ELASTOMERIC RUBBER, AN ADHESIVE LAYER IN BETWEEN, ADHESIVE COMPRISES WATER DISPERSABLE POLYISOCYANATE, A HALOGENATED POLYOLEFIN AND CURING AGENT | LORD CORPORATION (US) | 1998-02-10 | — | — | US | claimed |
| WO-1997000904-A2 | AQUEOUS ADHESIVE COMPOSITIONS | LORD CORPORATION (US) | 1997-01-09 | — | — | WO | claimed |
| EP-0449110-B1 | 2,2-Dialkylpentane-1,5-diisocyanates, -diurethanes, and -dicarbamic acid chlorides, process for their preparation and their use | BASF AG (DE) | 1996-06-05 | — | — | EP | claimed |
| US-4664979-A | DURABLE MAGNETIC TAPES | FUJI PHOTO FILM CO., LTD. (JP) | 1987-05-12 | — | — | US | claimed |
| US-4384101-A | EPOXIDE, ISOCYANATE, TRIALLYL CYANURATE AS CROSSLINKER FOR THERMOSETTING ELECTRICAL INSULATION | BBC BROWN, BOVERI & COMPANY, LIMITED (CH) | 1983-05-17 | — | — | US | claimed |
| US-4321350-A | Process for the catalytic setting of polyurethane molding compositions | GAMBRO DIALYSATOREN KG (DE) | 1982-03-23 | — | — | 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 |