⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL25947306 | 0.89 | GGPS1 (0.43) | — | |
| Hydrogen Sulfide SCHEMBL11683358 | 0.87 | GGPS1 (0.41) | — | |
| SCHEMBL10036573 | 0.82 | TSHR (0.33) | — | |
| SCHEMBL14607340 | 0.81 | — | — | |
| SCHEMBL17525853 | 0.81 | — | — | |
| SCHEMBL7872255 | 0.81 | — | — | |
| SCHEMBL10704293 | 0.80 | GGPS1 (0.44) | — | |
| SCHEMBL5331888 | 0.75 | — | — | |
| SCHEMBL13767876 | 0.75 | — | — | |
| SCHEMBL12075585 | 0.73 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117941031-A | Film quality improver, method for forming thin film using same, and semiconductor substrate produced thereby | 秀博瑞殷株式公社 | 2024-04-26 | — | — | CN | 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 |