⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5995298 | 0.95 | CA2 (0.32) | — | |
| SCHEMBL5995283 | 0.89 | CA2 (0.35) | — | |
| SCHEMBL8208731 | 0.74 | — | — | |
| SCHEMBL8520660 | 0.73 | CA2 (0.38) | — | |
| SCHEMBL5993927 | 0.72 | — | — | |
| SCHEMBL13206291 | 0.71 | F2 (0.44) | — | |
| SCHEMBL8205110 | 0.69 | HSD17B10 (0.32) | — | |
| SCHEMBL13206292 | 0.69 | F2 (0.48) | — | |
| SCHEMBL13206287 | 0.67 | CYP1A2 (0.39) | — | |
| SCHEMBL5995611 | 0.67 | CHRNB2 (0.32) | — |
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 | claimed |
| WO-1998043981-A1 | ANTIBACTERIAL SUBSTITUTED 7-ACYLAMINO-3-(METHYLHYDRAZONO)METHYL -CEPHALOSPORINS AND INTERMEDIATES | BIOCHEMIE GESELLSCHAFT MBH (AT) | 1998-10-08 | — | — | WO | claimed |