⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1248824 | 0.88 | — | — | |
| SCHEMBL9634213 | 0.79 | — | — | |
| SCHEMBL16469013 | 0.78 | — | — | |
| SCHEMBL83493 | 0.78 | — | — | |
| SCHEMBL28497585 | 0.77 | — | — | |
| SCHEMBL27728311 | 0.76 | LMNA (0.50) | — | |
| SCHEMBL26752262 | 0.76 | LMNA (0.50) | — | |
| SCHEMBL27545589 | 0.76 | LMNA (0.50) | — | |
| SCHEMBL29655012 | 0.74 | ALDH1A1 (0.32) | — | |
| Water SCHEMBL9684502 | 0.74 | LMNA (0.44) | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20230227415-A1 | TRIAZINE BENZOATE COMPOUND AND APPLICATION THEREOF | SHENYANG SINOCHEM AGROCHEMICALS R&D CO., LTD. (CN) | 2023-07-20 | — | — | US | disclosed |
| US-20230227415-A1 | TRIAZINE BENZOATE COMPOUND AND APPLICATION THEREOF | SHENYANG SINOCHEM AGROCHEMICALS R&D CO., LTD. (CN) | 2023-07-20 | — | — | US | disclosed |
| EP-4169910-A1 | TRIAZINE BENZOATE COMPOUND AND APPLICATION THEREOF | Shenyang Sinochem Agrochemicals R & D Co., Ltd. (CN) | 2023-04-26 | — | — | EP | disclosed |
| US-20120194766-A1 | IPS OR FFS-MODE LIQUID-CRYSTAL DISPLAY DEVICE | FUJIFILM CORPORATION (JP) | 2012-08-02 | — | — | US | disclosed |
| US-20120194766-A1 | IPS OR FFS-MODE LIQUID-CRYSTAL DISPLAY DEVICE | FUJIFILM CORPORATION (JP) | 2012-08-02 | — | — | US | disclosed |
| EP-0719839-B1 | Phthalocyanine compounds and optical recording media comprising them | MITSUI CHEMICALS INC (JP) | 2001-07-25 | — | — | EP | disclosed |
| US-5693396-A | NEAR INFRARED LIGHT ABSORBERS | MITSUI TOATSU CHEMICALS, INC. (JP) | 1997-12-02 | — | — | US | disclosed |
| EP-0719839-A2 | Phthalocyanine compounds and optical recording media comprising them | MITSUI TOATSU CHEMICALS, Inc. (JP) | 1996-07-03 | — | — | EP | disclosed |