⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7096429 | 0.76 | — | — | |
| SCHEMBL28265464 | 0.72 | CTSD (0.32) | — | |
| SCHEMBL7860560 | 0.68 | — | — | |
| SCHEMBL4663040 | 0.68 | — | — | |
| Hydrochloric Acid SCHEMBL4665064 | 0.65 | — | — | |
| SCHEMBL6441732 | 0.60 | ALDH1A1 (0.33) | — | |
| SCHEMBL7102339 | 0.57 | CRHBP (0.33) | — | |
| SCHEMBL8853537 | 0.55 | CTSD (0.31) | — | |
| SCHEMBL13209242 | 0.55 | CTSD (0.31) | — | |
| SCHEMBL27894201 | 0.55 | CTSD (0.31) | — |
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-1006119-B1 | NOVEL CRYSTALLINE ION-ASSOCIATION SUBSTANCE, PROCESS FOR PRODUCING THE SAME, AND LATENT PHOTOPOLYMERIZATION INITIATOR | AUTEX INC (JP) | 2003-09-03 | — | — | EP | claimed |
| US-6387975-B1 | ORGANOMETALLIC COMPOUND COMPLEX | AUTEX, INC. (JP) | 2002-05-14 | — | — | US | claimed |
| EP-1006119-A1 | NOVEL CRYSTALLINE ION-ASSOCIATION SUBSTANCE, PROCESS FOR PRODUCING THE SAME, AND LATENT PHOTOPOLYMERIZATION INITIATOR | AUTEX, INC. (JP) | 2000-06-07 | — | — | EP | claimed |
| EP-1006119-B1 | NOVEL CRYSTALLINE ION-ASSOCIATION SUBSTANCE, PROCESS FOR PRODUCING THE SAME, AND LATENT PHOTOPOLYMERIZATION INITIATOR | AUTEX INC (JP) | 2003-09-03 | — | — | EP | disclosed |
| US-6387975-B1 | ORGANOMETALLIC COMPOUND COMPLEX | AUTEX, INC. (JP) | 2002-05-14 | — | — | US | disclosed |
| EP-1006119-A1 | NOVEL CRYSTALLINE ION-ASSOCIATION SUBSTANCE, PROCESS FOR PRODUCING THE SAME, AND LATENT PHOTOPOLYMERIZATION INITIATOR | AUTEX, INC. (JP) | 2000-06-07 | — | — | EP | disclosed |