⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7922403 | 0.92 | — | — | |
| SCHEMBL11285954 | 0.81 | — | — | |
| SCHEMBL7921908 | 0.73 | — | — | |
| SCHEMBL7923855 | 0.70 | — | — | |
| SCHEMBL28143917 | 0.70 | — | — | |
| SCHEMBL14963939 | 0.69 | — | — | |
| SCHEMBL20223619 | 0.67 | CA1 (0.39) | — | |
| SCHEMBL20223620 | 0.67 | MEN1 (0.33) | — | |
| SCHEMBL4357995 | 0.67 | — | — | |
| SCHEMBL11282027 | 0.67 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20180155530-A1 | FLAME-RETARDANT POLYALLYL AND POLYALKENYL ISOCYANURATE COMPOUNDS | INTERNATIONAL BUSINESS MACHINES CORPORATION | 2018-06-07 | — | — | US | disclosed |
| US-20180155529-A1 | FLAME-RETARDANT POLYALLYL AND POLYALKENYL ISOCYANURATE COMPOUNDS | INTERNATIONAL BUSINESS MACHINES CORPORATION | 2018-06-07 | — | — | US | disclosed |
| US-6232281-B1 | PHTHALOCYANINE, NAPHTHALOCYANINE, ANTHRALOCYANINE, AND PHENANTHRALOCYANINE COMPLEXES; BLEACHES FOR LAUNDRY DETERGENTS | PROCTER & GAMBLE CO. | 2001-05-15 | — | — | US | disclosed |
| CN-1251127-A | Singlet oxygen generators with improved heavy atom effect | PROCTER & GAMBLE (US) | 2000-04-19 | — | — | CN | disclosed |
| EP-0960182-A2 | SINGLET OXYGEN GENERATORS HAVING ENHANCED HEAVY ATOM EFFECT | THE PROCTER & GAMBLE COMPANY (US) | 1999-12-01 | — | — | EP | disclosed |
| WO-1998032824-A2 | SINGLET OXYGEN GENERATORS HAVING ENHANCED HEAVY ATOM EFFECT | THE PROCTER & GAMBLE COMPANY (US) | 1998-07-30 | — | — | WO | disclosed |