⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2535849 | 0.92 | — | — | |
| SCHEMBL2533089 | 0.90 | LMNA (0.43) | — | |
| SCHEMBL1722027 | 0.82 | — | — | |
| SCHEMBL2540597 | 0.82 | TSHR (0.35) | — | |
| SCHEMBL3793985 | 0.82 | ALDH1A1 (0.36) | — | |
| SCHEMBL28728516 | 0.81 | ALDH1A1 (0.50) | — | |
| SCHEMBL28729612 | 0.81 | — | — | |
| SCHEMBL22071625 | 0.79 | ALDH1A1 (0.35) | — | |
| SCHEMBL10339296 | 0.79 | TSHR (0.39) | — | |
| SCHEMBL10338791 | 0.79 | TSHR (0.39) | — |
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 36 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2021107870-A1 | ANTIMICROBIAL AGENT, COATING FORMULATION, COMPOSITE SURFACE COATING AND METHODS OF PREPARING THE SAME | AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) | 2021-06-03 | — | — | WO | claimed |
| CN-114316102-B | Alkoxy magnesium carrier, polyethylene catalyst and preparation method thereof | 北京吉海川科技发展有限公司 | 2023-12-22 | — | — | CN | disclosed |
| CN-114316102-A | Alkoxy magnesium carrier, polyethylene catalyst and preparation method thereof | 北京吉海川科技发展有限公司 | 2022-04-12 | — | — | CN | disclosed |
| EP-2387565-B1 | 2,4-PYRIMIDINEDIAMINE COMPOUNDS FOR TREATMENT OF INFLAMMATORY DISORDERS | RIGEL PHARMACEUTICALS INC (US) | 2016-12-14 | — | — | EP | disclosed |
| US-8575165-B2 | Methods for treating inflammatory disorders using 2,4-pyrimidinediamine compounds | RIGEL PHARMACEUTICALS, INC. (US) | 2013-11-05 | — | — | US | disclosed |
| US-8334297-B2 | 2,4-pyrimidinediamine compounds for treatment of inflammatory disorders | RIGEL PHARMACEUTICALS INC. (US) | 2012-12-18 | — | — | US | disclosed |
| EP-2387565-A2 | 2,4-PYRIMIDINEDIAMINE COMPOUNDS FOR TREATMENT OF INFLAMMATORY DISORDERS | Rigel Pharmaceuticals, Inc. (US) | 2011-11-23 | — | — | EP | disclosed |
| EP-2387402-A2 | METHODS FOR TREATING INFLAMMATORY DISORDERS USING 2,4-PYRIMIDINEDIAMINE COMPOUNDS | Rigel Pharmaceuticals, Inc. (US) | 2011-11-23 | — | — | EP | disclosed |
| US-8044070-B2 | Heteroaryloxy nitrogenous saturated heterocyclic derivative | MSD K.K. (JP) | 2011-10-25 | — | — | US | disclosed |
| US-8038799-B2 | Substrate processing apparatus and substrate processing method | KURITA WATER INDUSTRIES LTD. (JP) | 2011-10-18 | — | — | US | disclosed |
| US-4552886-A | Fungicidal pyridylmethyl-amines | ELI LILLY AND COMPANY (US) | 1985-11-12 | — | — | US | disclosed |
| US-4501746-A | HERBICIDES; PLANT GROWTH REGULATORS | ELI LILLY AND COMPANY (US) | 1985-02-26 | — | — | US | disclosed |
| EP-0097013-A2 | Fungicidal heterocyclic amines | ELI LILLY AND COMPANY (US) | 1983-12-28 | — | — | EP | disclosed |
| EP-0048117-A2 | In-mold coating compositions containing a non-isocyanate-reactive unsaturated resin, a non-isocyanate-reactive monomer and a free isocyanate-containing compound | ICI AMERICAS INC. (US) | 1982-03-24 | — | — | EP | disclosed |
| US-4232133-A | ETHYLENICALLY UNSATURATED MONOMER, POLYURETHANES | ICI AMERICAS INC. (US) | 1980-11-04 | — | — | US | disclosed |
| US-4195146-A | THERMOSETTING RESINS | ICI AMERICAS INC. (US) | 1980-03-25 | — | — | US | disclosed |
| EP-0008170-A1 | Polyisocyanurate containing moulding compositions | ICI AMERICAS INC. (US) | 1980-02-20 | — | — | EP | disclosed |
| EP-0000658-A1 | Process for preparing ethylenically unsaturated isocyanurates | ICI AMERICAS INC. (US) | 1979-02-07 | — | — | EP | disclosed |
| EP-0000659-A1 | An isocyanurate composition formed by the trimerisation of an isocyanate group containing urethane of an aromatic polyisocyanate and a vinylidenecarbonyloxyalkanol and solutions, polymers and laminates obtained therefrom. | ICI AMERICAS INC. (US) | 1979-02-07 | — | — | EP | disclosed |
| US-4128537-A | COPPER COMPOUND CATALYST, TRIMERIZATION | ICI AMERICAS INC. (US) | 1978-12-05 | — | — | US | disclosed |