⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7868490 | 0.83 | KDM4E (0.35) | — | |
| SCHEMBL4061581 | 0.83 | ALDH1A1 (0.36) | — | |
| SCHEMBL8162404 | 0.81 | MAPT (0.36) | — | |
| SCHEMBL2457473 | 0.78 | KDM4E (0.39) | — | |
| SCHEMBL2455095 | 0.76 | ALDH1A1 (0.33) | — | |
| SCHEMBL9793489 | 0.73 | L3MBTL1 (0.39) | — | |
| SCHEMBL10826725 | 0.71 | ALDH1A1 (0.35) | — | |
| SCHEMBL10826576 | 0.71 | KDM4E (0.34) | — | |
| SCHEMBL18159206 | 0.70 | MAPT (0.36) | — | |
| SCHEMBL10826690 | 0.70 | SQOR (0.36) | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0882768-B1 | Method for producing of phthalocyanine compound | NIPPON CATALYTIC CHEM IND (JP) | 2001-12-19 | — | — | EP | disclosed |
| US-6034236-A | REACTING A PHTHALONITRILE WITH A METAL OXIDE IN PRESENCE OF A SULFONIC ACID CATALYST | NIPPON SHOKUBAI CO., LTD. (JP) | 2000-03-07 | — | — | US | disclosed |
| EP-0523959-B1 | Novel phthalocyanine compounds, production method thereof, and near infrared ray absorption materials containing the same | NIPPON CATALYTIC CHEM IND (JP) | 1999-10-13 | — | — | EP | disclosed |
| EP-0882768-A2 | Method for producing of phthalocyanine compound | NIPPON SHOKUBAI CO., LTD. (JP) | 1998-12-09 | — | — | EP | disclosed |
| US-5359056-A | Lightfastness, solvent solubility | NIPPON SHOKUBAI CO., LTD. (JP) | 1994-10-25 | — | — | US | disclosed |
| EP-0523959-A2 | Novel phthalocyanine compounds, production method thereof, and near infrared ray absorption materials containing the same | NIPPON SHOKUBAI CO., LTD. (JP) | 1993-01-20 | — | — | EP | disclosed |