⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL25895229 | 0.86 | ROCK2 (0.33) | — | |
| SCHEMBL17897990 | 0.83 | DPP4 (0.35) | — | |
| SCHEMBL10270142 | 0.82 | ROCK2 (0.38) | — | |
| SCHEMBL12375166 | 0.78 | HSD11B1 (0.37) | — | |
| SCHEMBL25912606 | 0.76 | — | — | |
| SCHEMBL12375165 | 0.74 | CES2 (0.39) | — | |
| SCHEMBL7603415 | 0.74 | RIPK1 (0.35) | — | |
| SCHEMBL25919920 | 0.73 | FASN (0.43) | — | |
| SCHEMBL1911777 | 0.72 | CES2 (0.42) | — | |
| SCHEMBL15199107 | 0.71 | HSD11B1 (0.34) | — |
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-11739074-B2 | Ras inhibitors | Revolution Medicines, Inc. (US) | 2023-08-29 | — | — | US | disclosed |
| US-20230233569-A1 | METHODS FOR DELAYING, PREVENTING, AND TREATING ACQUIRED RESISTANCE TO RAS INHIBITORS | WILMINGTON TRUST, NATIONAL ASSOCIATION, AS AGENT | 2023-07-27 | — | — | US | disclosed |