⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1275940 | 0.87 | — | — | |
| SCHEMBL4409759 | 0.67 | — | — | |
| SCHEMBL29767319 | 0.50 | — | — | |
| SCHEMBL28483822 | 0.50 | — | — | |
| SCHEMBL9615101 | 0.50 | — | — | |
| SCHEMBL29384689 | 0.50 | — | — | |
| SCHEMBL28972526 | 0.50 | — | — | |
| SCHEMBL6587 | 0.50 | — | — | |
| SCHEMBL11046559 | 0.50 | — | — | |
| SCHEMBL5383540 | 0.50 | — | — |
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-6270594-B1 | CONTINUOUS CASTING, CONTROLLED HOT ROLLING AND ACCELERATED COOLING OF A LOW-SILICON, TITANIUM, NIOBIUM AND VANADIUM-CONTAINING STEEL TO PRODUCE ROLLED PRODUCT WHICH HAS GOOD MECHANICHAL PROPERTIES AND ALLOWS IMPROVED PRODUCTIVITY | BETHLEHEM STEEL CORPORATION | 2001-08-07 | — | — | US | disclosed |
| US-5858130-A | HAVING CONTROLLED AMOUNTS OF CARBON, VANADIUM, TITANIUM, SILICON AND NIOBIUM | BETHLEHEM STEEL CORPORATION (US) | 1999-01-12 | — | — | US | disclosed |