⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL23264491 | 0.67 | — | — | |
| SCHEMBL20158590 | 0.65 | — | — | |
| SCHEMBL428751 | 0.65 | — | — | |
| Methane SCHEMBL28352715 | 0.62 | — | — | |
| SCHEMBL28444039 | 0.62 | — | — | |
| SCHEMBL3935570 | 0.62 | — | — | |
| SCHEMBL18610251 | 0.61 | — | — | |
| SCHEMBL8017265 | 0.61 | — | — | |
| SCHEMBL31257201 | 0.61 | — | — | |
| SCHEMBL19175824 | 0.61 | — | — |
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 18 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-11041048-B2 | Polyhemiaminal and polyhexahydrotriazine materials from 1,4 conjugate addition reactions | INTERNATIONAL BUSINESS MACHINES CORPORATION (US) | 2021-06-22 | — | — | US | disclosed |
| US-20190177481-A1 | POLYHEMIAMINAL AND POLYHEXAHYDROTRIAZINE MATERIALS FROM 1,4 CONJUGATE ADDITION REACTIONS | INTERNATIONAL BUSINESS MACHINES CORPORATION | 2019-06-13 | — | — | US | disclosed |
| US-10316143-B2 | Polyhemiaminal and polyhexahydrotriazine materials from 1,4 conjugate addition reactions | INTERNATIONAL BUSINESS MACHINES CORPORATION (US) | 2019-06-11 | — | — | US | disclosed |
| US-9637596-B2 | Polyhemiaminal and polyhexahydrotriazine materials from 1,4 conjugate addition reactions | INTERNATIONAL BUSINESS MACHINES CORPORATION (US) | 2017-05-02 | — | — | US | disclosed |
| US-20170002145-A1 | POLYHEMIAMINAL AND POLYHEXAHYDROTRIAZINE MATERIALS FROM 1,4 CONJUGATE ADDITION REACTIONS | INTERNATIONAL BUSINESS MACHINES | 2017-01-05 | — | — | US | disclosed |
| US-9458299-B1 | Polyhemiaminal and polyhexahydrotriazine materials from 1,4 conjugate addition reactions | INTERNATIONAL BUSINESS MACHINES CORPORATION (US) | 2016-10-04 | — | — | US | disclosed |
| US-20160264744-A1 | POLYHEMIAMINAL AND POLYHEXAHYDROTRIAZINE MATERIALS FROM 1,4 CONJUGATE ADDITION REACTIONS | INTERNATIONAL BUSINESS MACHINES CORPORATION | 2016-09-15 | — | — | US | disclosed |
| US-20160264734-A1 | Polyhemiaminal And Polyhexahydrotriazine Materials From 1,4 Conjugate Addition Reactions | INTERNATIONAL BUSINESS MACHINES CORPORATION | 2016-09-15 | — | — | US | disclosed |
| US-4830827-A | FOR METALS | THE DOW CHEMICAL COMPANY (US) | 1989-05-16 | — | — | US | disclosed |
| EP-0174794-A2 | Textile treatment | WOOL DEVELOPMENT INTERNATIONAL LIMITED (GB) | 1986-03-19 | — | — | EP | disclosed |
| US-4304690-A | DETERGENTS | TEXACO DEVELOPMENT CORP. (US) | 1981-12-08 | — | — | US | disclosed |
| US-4298708-A | SALT OF PYRROLIDONECARBOXYLIC ACID | TEXACO DEVELOPMENT CORP. (US) | 1981-11-03 | — | — | US | disclosed |
| US-4239916-A | Isocyanurate foam catalyst | TEXACO DEVELOPMENT CORP. (US) | 1980-12-16 | — | — | US | disclosed |
| US-4235811-A | OIL AND FUEL ADDITIVES; CATALYSTS FOR MAKING POLYISOCYANURATES | TEXACO DEVELOPMENT CORP. (US) | 1980-11-25 | — | — | US | disclosed |
| US-4099004-A | CATALYSTS FOR ISOCYANURATE FOAMS | TEXACO DEVELOPMENT CORPORATION (US) | 1978-07-04 | — | — | US | disclosed |
| US-4026837-A | POTASSIUM SALT OF A CARBOXY-TERMINATED BUTADIENE-ACRYLONITRILE COPOLYMER | TEXACO DEVELOPMENT CORPORATION (US) | 1977-05-31 | — | — | US | disclosed |
| US-4026836-A | AMINOMETHACRYLATE SALT CATALYST, REACTING A POLYETHER OR POLYESTER WITH AN AROMATIC POLYISOCYANURATE | TEXACO DEVELOPMENT CORPORATION (US) | 1977-05-31 | — | — | US | disclosed |
| US-4009130-A | POLY-ETHER(ESTER)URETHANES | TEXACO DEVELOPMENT CORPORATION (US) | 1977-02-22 | — | — | US | disclosed |