⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2496092 | 0.77 | — | — | |
| SCHEMBL22842754 | 0.76 | ALDH1A1 (0.31) | — | |
| SCHEMBL17151272 | 0.75 | — | — | |
| SCHEMBL22915383 | 0.74 | — | — | |
| SCHEMBL19728786 | 0.74 | — | — | |
| SCHEMBL22667357 | 0.71 | — | — | |
| SCHEMBL20096384 | 0.70 | — | — | |
| SCHEMBL2491992 | 0.69 | — | — | |
| SCHEMBL179208 | 0.68 | MAPK1 (0.33) | — | |
| SCHEMBL12226951 | 0.67 | TSHR (0.41) | — |
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-20230059250-A1 | Anti-CD37 Antibody-Maytansine Conjugates and Methods of Use Thereof | ARES CAPITAL CORPORATION, AS COLLATERAL AGENT | 2023-02-23 | — | — | US | disclosed |
| US-20180113237-A1 | AMPHIPHILIC BRANCHED POLYDIORGANOSILOXANE MACROMERS | ALCON INC. (CH) | 2018-04-26 | — | — | US | disclosed |