⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5049826 | 1.00 | — | — | |
| SCHEMBL18817541 | 0.80 | CA2 (0.50) | — | |
| SCHEMBL7154999 | 0.80 | CA2 (0.50) | — | |
| SCHEMBL6125258 | 0.80 | — | — | |
| SCHEMBL4135508 | 0.80 | — | — | |
| SCHEMBL14501495 | 0.80 | CA2 (0.55) | — | |
| SCHEMBL740693 | 0.80 | — | — | |
| SCHEMBL10423868 | 0.76 | — | — | |
| SCHEMBL6583366 | 0.76 | — | — | |
| SCHEMBL935836 | 0.76 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-7332261-B2 | Phthalocyanine compound, process for preparing the same, and optical recording medium containing the same | CIBA SPECIALTY CHEMICALS CORPORATION (US) | 2008-02-19 | — | — | US | disclosed |
| EP-1482013-B1 | PHTHALOCYANINE COMPOUND, PROCESS FOR PRODUCING THE SAME, AND OPTICAL RECORDING MEDIUM CONTAINING THE SAME | CIBA SC HOLDING AG (CH) | 2007-07-18 | — | — | EP | disclosed |
| US-20050201265-A1 | Phthalocyanine compound, process for producing the same, and optical recording medium containing the same | MITSUI CHEMICALS, INC. (JP) | 2005-09-15 | — | — | US | disclosed |
| EP-1482013-A1 | PHTHALOCYANINE COMPOUND, PROCESS FOR PRODUCING THE SAME, AND OPTICAL RECORDING MEDIUM CONTAINING THE SAME | MITSUI CHEMICALS, INC. (JP) | 2004-12-01 | — | — | EP | disclosed |