⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8906766 | 0.81 | — | — | |
| SCHEMBL5319098 | 0.75 | — | — | |
| SCHEMBL8184066 | 0.75 | NPC1 (0.31) | — | |
| SCHEMBL27590677 | 0.74 | — | — | |
| SCHEMBL8034140 | 0.72 | — | — | |
| SCHEMBL18670831 | 0.71 | — | — | |
| SCHEMBL27869425 | 0.71 | — | — | |
| SCHEMBL8038380 | 0.71 | KDM4E (0.33) | — | |
| SCHEMBL1673815 | 0.71 | ALDH1A1 (0.40) | — | |
| Hydrochloric Acid SCHEMBL5537163 | 0.70 | KDM4E (0.33) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0626866-A4 | THE USE OF CAROTENOPORPHYRINS AS TUMOR LOCALIZING AGENTS FOR DIAGNOSIS, VISUALIZATION AND DELIVERY OF SENSITIZERS TO TUMOR TISSUES. | — | 1994-12-21 | — | — | EP | disclosed |
| EP-0626866-A1 | THE USE OF CAROTENOPORPHYRINS AS TUMOR LOCALIZING AGENTS FOR DIAGNOSIS, VISUALIZATION AND DELIVERY OF SENSITIZERS TO TUMOR TISSUES | ARIZONA BOARD OF REGENTS (US) | 1994-12-07 | — | — | EP | disclosed |
| WO-1994008631-A1 | THE USE OF CAROTENOPORPHYRINS AS TUMOR LOCALIZING AGENTS FOR DIAGNOSIS, VISUALIZATION AND DELIVERY OF SENSITIZERS TO TUMOR TISSUES | ARIZONA BOARD OF REGENTS (US) | 1994-04-28 | — | — | WO | disclosed |