⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8117869 | 0.84 | MMP2 (0.33) | — | |
| SCHEMBL8112128 | 0.84 | — | — | |
| SCHEMBL8112131 | 0.84 | — | — | |
| SCHEMBL8110857 | 0.82 | — | — | |
| SCHEMBL8110853 | 0.82 | — | — | |
| SCHEMBL3729414 | 0.80 | — | — | |
| SCHEMBL3733127 | 0.80 | — | — | |
| SCHEMBL3729417 | 0.80 | — | — | |
| SCHEMBL17265346 | 0.76 | — | — | |
| SCHEMBL8110514 | 0.75 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6075135-A | CHEMICAL INTERMEDIATE FOR PRODUCTION OF DAUNORUBICIN OR ADRIAMYCIN DERIVATIVES WITH HIGH WATER SOLUBILITY WHICH ARE USED AS INJECTABLE ANTICARCINOGENIC/ANTITUMOR AGENTS | ZAIDAN HOJIN BISEIBUTSU KAGAKU KENKYU KAI (JP) | 2000-06-13 | — | — | US | claimed |
| US-6075135-A | CHEMICAL INTERMEDIATE FOR PRODUCTION OF DAUNORUBICIN OR ADRIAMYCIN DERIVATIVES WITH HIGH WATER SOLUBILITY WHICH ARE USED AS INJECTABLE ANTICARCINOGENIC/ANTITUMOR AGENTS | ZAIDAN HOJIN BISEIBUTSU KAGAKU KENKYU KAI (JP) | 2000-06-13 | — | — | US | disclosed |
| US-5958889-A | HIGH ANTICANCER OR ANTITUMOR ACTIVITY WITH LOW TOXICITY | ZAIDAN HOJIN BISEIBUTSU KAGAKU KENKYU KAI (JP) | 1999-09-28 | — | — | US | disclosed |
| EP-0834517-A1 | NOVEL ANTHRACYCLINE DERIVATIVES HAVING 4-AMINO-2,4,6-TRIDEOXY-2-FLUORO-MANNOPYRANOSYL GROUP | ZAIDAN HOJIN BISEIBUTSU KAGAKU KENKYU KAI (JP) | 1998-04-08 | — | — | EP | disclosed |