⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL31008513 | 0.93 | CA4 (0.35) | — | |
| Silver SCHEMBL9068798 | 0.93 | — | — | |
| Potassium Ion SCHEMBL10640244 | 0.93 | CA4 (0.35) | — | |
| Trifluoroacetic Acid SCHEMBL31606587 | 0.74 | CA4 (0.38) | — | |
| Trifluoroacetic Acid SCHEMBL379347 | 0.74 | CA4 (0.38) | — | |
| Zinc Ion SCHEMBL4581329 | 0.73 | THRB (0.33) | — | |
| Trifluoroacetic Acid SCHEMBL28696706 | 0.72 | CA4 (0.36) | — | |
| Trifluoroacetic Acid SCHEMBL723408 | 0.72 | CA4 (0.36) | — | |
| Zinc Ion SCHEMBL4582401 | 0.69 | THRB (0.42) | — | |
| Trifluoroacetic Acid SCHEMBL6912539 | 0.67 | CA4 (0.38) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7452661-B2 | Photothermographic materials incorporating antifoggants | CARESTREAM HEALTH, INC. (US) | 2008-11-18 | — | — | US | disclosed |
| US-20080206688-A1 | PHOTOTHERMOGRAPHIC MATERIALS INCORPORATING ANTIFOGGANTS | QUANTUM MEDICAL IMAGING, L.L.C. | 2008-08-28 | — | — | US | disclosed |