⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16766419 | 0.80 | — | — | |
| SCHEMBL28417688 | 0.78 | — | — | |
| SCHEMBL7253057 | 0.75 | ALDH1A1 (0.36) | — | |
| SCHEMBL21021719 | 0.73 | — | — | |
| SCHEMBL3648258 | 0.73 | — | — | |
| SCHEMBL27514199 | 0.73 | — | — | |
| SCHEMBL8373174 | 0.73 | ALDH1A1 (0.35) | — | |
| SCHEMBL16814665 | 0.72 | — | — | |
| SCHEMBL16766332 | 0.71 | — | — | |
| SCHEMBL11688709 | 0.71 | — | — |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-60218387-A | — | — | None | — | — | JP | 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 |
| EP-0218736-B1 | A KETENE S,S-ACETAL DERIVATIVE, A PROCESS FOR MANUFACTURING THEREOF AND A METHOD FOR CURING MYCOSIS BY ADMINISTERING IT | NIHON NOHYAKU CO., LTD. (JP) | 1993-04-07 | — | — | EP | disclosed |
| US-4738976-A | Antimycotic agent and fungicidal agent | NIHON NOHYAKU CO., LTD. (JP) | 1988-04-19 | — | — | US | disclosed |
| EP-0218736-A1 | A ketene S,S-acetal derivative, a process for manufacturing thereof and a method for curing mycosis by administering it | NIHON NOHYAKU CO., LTD. (JP) | 1987-04-22 | — | — | EP | disclosed |
| US-4636519-A | FUNGICIDE | NIHON NOHYAKU CO., LTD. (JP) | 1987-01-13 | — | — | US | disclosed |
| JP-S60218387-A | KETENE S,S-ACETAL | NIPPON NOHYAKU CO LTD | 1985-11-01 | — | — | JP | disclosed |