⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2904 | 0.82 | — | — | |
| SCHEMBL27946387 | 0.82 | — | — | |
| SCHEMBL9818248 | 0.78 | — | — | |
| SCHEMBL3860578 | 0.76 | — | — | |
| SCHEMBL8500942 | 0.76 | — | — | |
| SCHEMBL25399170 | 0.76 | — | — | |
| SCHEMBL7397565 | 0.76 | — | — | |
| Water SCHEMBL4084932 | 0.76 | — | — | |
| SCHEMBL117680 | 0.76 | — | — | |
| SCHEMBL1525584 | 0.76 | — | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114921114-B | Artificial protein-based structural chromogenic material and preparation method thereof | 大连理工大学 | 2023-05-05 | — | — | CN | claimed |
| CN-110358163-B | Rubber composition and rubber passage of horse race | 厦门市金汤橡塑有限公司 | 2021-09-07 | — | — | CN | claimed |
| CN-115785545-B | Rubber composition and vulcanized rubber | 中国石油化工股份有限公司 | 2024-02-13 | — | — | CN | disclosed |
| CN-114921114-B | Artificial protein-based structural chromogenic material and preparation method thereof | 大连理工大学 | 2023-05-05 | — | — | CN | disclosed |
| US-6194579-B1 | PROVIDING QUANTITY OF 7-KETO CAMPTOTHECIN; SELECTIVELY SUBSTITUTING LEAVING GROUP AT C7 CARBON OF 7-KETO CAMPTOTHECIN; SELECTIVELY DERIVATIZING C7 CARBON | BIONUMERIK PHARMACEUTICALS, INC. | 2001-02-27 | — | — | US | disclosed |
| US-6028078-A | Highly lipophilic camptothecin derivatives | BIONUMERIK PHARMACEUTICALS, INC. (US) | 2000-02-22 | — | — | US | disclosed |
| US-5910491-A | Highly lipophilic camptothecin derivatives | BIONUMERIK PHARMACEUTICALS, INC. (US) | 1999-06-08 | — | — | US | disclosed |