⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9388096 | 0.84 | — | — | |
| SCHEMBL3454044 | 0.84 | — | — | |
| SCHEMBL11344532 | 0.83 | — | — | |
| SCHEMBL11339478 | 0.80 | BCL2L1 (0.30) | — | |
| SCHEMBL5470460 | 0.74 | LMNA (0.32) | — | |
| SCHEMBL8184066 | 0.73 | NPC1 (0.31) | — | |
| SCHEMBL11569700 | 0.73 | LMNA (0.31) | — | |
| Hydrochloric Acid SCHEMBL16188244 | 0.73 | LMNA (0.31) | — | |
| Hydrochloric Acid SCHEMBL16188262 | 0.73 | LMNA (0.31) | — | |
| SCHEMBL9294829 | 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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1989012049-A1 | DERIVATIVES OF METALLOPORPHYRINES, THEIR PREPARATION, APPLICATION FOR THERAPEUTICAL PURPOSES AND USE IN PREPARING HYBRID MOLECULES | CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS (FR) | 1989-12-14 | — | — | WO | disclosed |
| US-4256597-A | DETERGENT AND PHOTOINITIATOR COMPRISING A PORPHINE OR MONO, DI, OR TRIAZO PORPHINE, OR PHTHALOCYANINE COMPOUND; WATER SOLUBILITY; STAIN REMOVAL | THE PROCTER & GAMBLE COMPANY (US) | 1981-03-17 | — | — | US | disclosed |
| US-4255273-A | COMPRISING A WATER-SOLUBLE PHOTOACTIVATOR AND A CATIONIC SUBSTANCE | THE PROCTER & GAMBLE COMPANY (US) | 1981-03-10 | — | — | US | disclosed |