⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16967420 | 1.00 | — | — | |
| SCHEMBL20893684 | 1.00 | — | — | |
| SCHEMBL19341731 | 1.00 | — | — | |
| SCHEMBL20554516 | 1.00 | — | — | |
| SCHEMBL7207320 | 1.00 | — | — | |
| SCHEMBL7524203 | 1.00 | — | — | |
| Hydrochloric Acid SCHEMBL7206500 | 0.97 | THRB (0.47) | — | |
| Hydrochloric Acid SCHEMBL7206505 | 0.97 | THRB (0.47) | — | |
| SCHEMBL20680439 | 0.88 | THRB (0.40) | — | |
| SCHEMBL15506651 | 0.84 | — | — |
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 3604 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 |
|---|---|---|---|---|---|---|---|
| US-6436477-B1 | — | — | None | — | — | US | claimed |
| US-20250376438-A1 | METHOD FOR PRODUCING ISOCYANATES VIA PHOSGENATION OF A MIXTURE OF (AR)ALIPHATIC DIAMINES AND CYCLOALIPHATIC DIAMINES | COVESTRO DEUTSCHLAND AG (DE) | 2025-12-11 | — | — | US | claimed |
| EP-3621944-B1 | METHOD FOR THE STABILISATION OF AT LEAST MONO-ALKYL-SUBSTITUTED DIAMINOCYCLOHEXANES | BASF SE (DE) | 2025-10-08 | — | — | EP | claimed |
| EP-4114914-B1 | FRAGRANCE PREMIX COMPOSITIONS AND RELATED CONSUMER PRODUCTS | PROCTER & GAMBLE (US) | 2025-06-25 | — | — | EP | claimed |
| EP-4543852-A1 | PRODUCING SPECIAL ISOCYANATES VIA CO-PHOSGENATION | Covestro Deutschland AG (DE) | 2025-04-30 | — | — | EP | claimed |
| EP-4543850-A1 | METHOD FOR PRODUCING ISOCYANTES VIA PHOSGENATION OF A MIXTURE OF (AR)ALIPHATIC DIAMINES AND CYCLOALIPHATIC DIAMINES | Covestro Deutschland AG (DE) | 2025-04-30 | — | — | EP | claimed |
| EP-4543851-A1 | METHOD AND DEVICE FOR PRODUCING ISOCYANATES | Covestro Deutschland AG (DE) | 2025-04-30 | — | — | EP | claimed |
| CN-115210352-B | Perfume premix compositions and related consumer products | 宝洁公司 | 2025-03-18 | — | — | CN | claimed |
| CN-119365443-A | Process for producing isocyanates by phosgenation of mixtures of (aromatic) aliphatic diamines and cycloaliphatic diamines | 科思创德国股份有限公司 | 2025-01-24 | — | — | CN | claimed |
| CN-119280865-A | Amine vaporizing device and amine vaporizing process | 山东新和成精化科技有限公司 | 2025-01-10 | — | — | CN | claimed |
| US-5087739-A | CIRCULATION PROCESS FOR THE PRODUCTION OF ALIPHATIC AND CYCLOALIPHATIC DIISOCYANATES | HUELS AKTIENGESELLSCHAFT (DE) | 1992-02-11 | — | — | US | claimed |
| EP-0443344-A2 | Epoxy resin systems containing methyl-2,6-cyclohexanediamine | AIR PRODUCTS AND CHEMICALS, INC. (US) | 1991-08-28 | — | — | EP | claimed |
| US-5025078-A | Curing agent; heat resistance, elongation and toughness | AIR PRODUCTS AND CHEMICALS, INC. (US) | 1991-06-18 | — | — | US | claimed |
| US-4851565-A | FROM DI- OR POLYAMINES, UREA AND MONOFUNCTIONAL ALCOHOL | BASF AKTIENGESELLSCHAFT (DE) | 1989-07-25 | — | — | US | claimed |
| US-4713476-A | REACTING DI- OR POLYAMINE, UREA AND ALCOHOL | BASF AKTIENGESELLSCHAFT (DE) | 1987-12-15 | — | — | US | claimed |
| EP-0018586-B2 | PROCESS FOR PREPARING ALIPHATIC AND CYCLOALIPHATIC DI- AND POLYURETHANES | BASF Aktiengesellschaft (DE) | 1987-01-07 | — | — | EP | claimed |
| US-4497963-A | ETHYLENICALLY UNSATURADED POLYMERS | BASF AKTIENGESELLSCHAFT (DE) | 1985-02-05 | — | — | US | claimed |
| EP-0018588-B1 | PROCESS FOR PREPARING ALIPHATIC AND CYCLOALIPHATIC DI- AND POLYURETHANES | BASF Aktiengesellschaft (DE) | 1982-12-29 | — | — | EP | claimed |
| EP-0018586-B1 | PROCESS FOR PREPARING ALIPHATIC AND CYCLOALIPHATIC DI- AND POLYURETHANES | BASF Aktiengesellschaft (DE) | 1982-12-08 | — | — | EP | claimed |
| EP-0018588-A1 | Process for preparing aliphatic and cycloaliphatic di- and polyurethanes | BASF Aktiengesellschaft (DE) | 1980-11-12 | — | — | EP | claimed |