⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8205113 | 0.79 | HSD17B10 (0.30) | — | |
| SCHEMBL8205876 | 0.75 | — | — | |
| SCHEMBL5096519 | 0.74 | HSD17B10 (0.31) | — | |
| SCHEMBL141255 | 0.68 | HSD17B10 (0.44) | — | |
| SCHEMBL180596 | 0.68 | — | — | |
| Ammonia Solution, Strong SCHEMBL6053342 | 0.65 | — | — | |
| SCHEMBL5995018 | 0.62 | — | — | |
| SCHEMBL8205138 | 0.62 | TSHR (0.32) | — | |
| SCHEMBL21750869 | 0.61 | HSD17B10 (0.37) | — | |
| SCHEMBL29178251 | 0.61 | TDP1 (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 |
|---|---|---|---|---|---|---|---|
| EP-0973780-A1 | ANTIBACTERIAL SUBSTITUTED 7-ACYLAMINO -3-(METHYLHYDRAZONO) METHYL-CEPHALOSPORINS AND INTERMEDIATES | BIOCHEMIE GESELLSCHAFT M.B.H. (AT) | 2000-01-26 | — | — | EP | disclosed |
| WO-1998043981-A1 | ANTIBACTERIAL SUBSTITUTED 7-ACYLAMINO-3-(METHYLHYDRAZONO)METHYL -CEPHALOSPORINS AND INTERMEDIATES | BIOCHEMIE GESELLSCHAFT MBH (AT) | 1998-10-08 | — | — | WO | disclosed |