⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9341283 | 1.00 | — | — | |
| SCHEMBL9340376 | 1.00 | — | — | |
| SCHEMBL25537294 | 0.84 | — | — | |
| SCHEMBL20939955 | 0.84 | — | — | |
| Hydrochloric Acid SCHEMBL21440357 | 0.81 | — | — | |
| SCHEMBL24030720 | 0.78 | — | — | |
| SCHEMBL3200709 | 0.78 | — | — | |
| SCHEMBL4433070 | 0.76 | — | — | |
| SCHEMBL1765140 | 0.75 | SLC22A1 (0.31) | — | |
| Hydrochloric Acid SCHEMBL1793669 | 0.73 | LMNA (0.33) | — |
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
Claimed or disclosed in 118 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107827832-B | Method for preparing IPDI-based polyisocyanate curing agent | 万华化学集团股份有限公司 | 2020-04-10 | — | — | CN | claimed |
| EP-2743251-B1 | 3-AMINOMETHYL-3, 5, 5-TRIMETHYL CYCLOHEXYLAMINE PREPARATION METHOD | WANHUA CHEMICAL GROUP CO LTD (CN) | 2018-06-27 | — | — | EP | claimed |
| CN-107827832-A | A kind of method for preparing the polyisocyanate curing agent based on IPDI | 万华化学集团股份有限公司 | 2018-03-23 | — | — | CN | claimed |
| US-8829245-B2 | 3-aminomethyl-3, 5, 5-trimethyl cyclohexylamine preparation method | WANHUA CHEMICAL GROUP CO., LTD. (CN) | 2014-09-09 | — | — | US | claimed |
| EP-2743251-A1 | 3-AMINOMETHYL-3, 5, 5-TRIMETHYL CYCLOHEXYLAMINE PREPARATION METHOD | Wanhua Chemical Group Co., Ltd. (CN) | 2014-06-18 | — | — | EP | claimed |
| US-20140142341-A1 | 3-AMINOMETHYL-3, 5, 5-TRIMETHYL CYCLOHEXYLAMINE PREPARATION METHOD | WANHUA CHEMICAL (NINGBO) CO., LTD. (CN) | 2014-05-22 | — | — | US | claimed |
| JP-9169706-A | — | — | None | — | — | JP | disclosed |
| US-20260092032-A1 | ISOPHORONE DIISOCYANATE COMPOSITION AND BLOCKED PRODUCT THEREOF | WANHUA CHEMICAL GROUP CO., LTD (CN) | 2026-04-02 | — | — | US | disclosed |
| EP-4047042-B1 | METHOD FOR PRODUCING A COMPOSITE STRUCTURE COMPRISING MAGNETIC FILLER MATERIAL EMBEDDED IN A RESIN MATRIX | TERALOOP OY (FI) | 2025-09-10 | — | — | EP | disclosed |
| EP-4570843-A1 | ISOPHORONE DIISOCYANATE COMPOSITION AND BLOCKED PRODUCT THEREOF | Wanhua Chemical Group Co., Ltd. (CN) | 2025-06-18 | — | — | EP | disclosed |
| WO-2024124426-A1 | ISOPHORONE DIISOCYANATE COMPOSITION AND BLOCKED PRODUCT THEREOF | 万华化学集团股份有限公司 | 2024-06-20 | — | — | WO | disclosed |
| US-11939280-B2 | Method for preparing isophorone diisocyanate | WANHUA CHEMICAL GROUP CO., LTD. (CN) | 2024-03-26 | — | — | US | disclosed |
| EP-3901133-B1 | METHOD FOR PREPARING ISOPHORONE DIISOCYANATE | WANHUA CHEMICAL GROUP CO LTD (CN) | 2023-09-13 | — | — | EP | disclosed |
| EP-0659734-A1 | Process for the preparation of 3-aminomethyl-3,5,5-trimethylcyclohexylamine | Degussa Aktiengesellschaft (DE) | 1995-06-28 | — | — | EP | disclosed |
| US-5406000-A | Reacting 3-cyano-3,5,5-trialkylcyclohexanone with ammonia; then catalytic hydrogenation | ELF/ATOCHEM NORTH AMERICA, INC. (US) | 1995-04-11 | — | — | US | disclosed |
| US-5371292-A | Preparation of 3-aminomethyl-3,5,5-trimethyl-cyclohexylamine | BASF AKTIENGESELLSCHAFT (DE) | 1994-12-06 | — | — | US | disclosed |
| US-5286906-A | HYDROGENATION OF 3-CYANO-3,5,5-TRIALKYLCYCLOHEXANONE USING RUTHENIUM-COBALT CATALYST IN THE PRESENCE OF AMMONIA; BY-PRODUCT INHIBITION | MITSUBISHI KASEI CORPORATION (JP) | 1994-02-15 | — | — | US | disclosed |
| EP-0534449-A2 | Process for the preparation of 3-aminomethyl-3,5,5-trialkylcyclohexylamine | Mitsubishi Chemical Corporation (JP) | 1993-03-31 | — | — | EP | disclosed |
| EP-0394968-A1 | Amination of carbonyls | UNION CARBIDE CHEMICALS AND PLASTICS COMPANY, INC. (US) | 1990-10-31 | — | — | EP | disclosed |
| EP-0394967-A1 | Reductive amination of carbonylnitriles and similar compounds | UNION CARBIDE CHEMICALS AND PLASTICS COMPANY, INC. (US) | 1990-10-31 | — | — | EP | disclosed |