⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL23024376 | 1.00 | — | — | |
| SCHEMBL23024375 | 1.00 | — | — | |
| SCHEMBL25345543 | 0.81 | RBP4 (0.31) | — | |
| SCHEMBL23024291 | 0.81 | RBP4 (0.31) | — | |
| SCHEMBL23024292 | 0.81 | RBP4 (0.31) | — | |
| SCHEMBL29604198 | 0.79 | DRD2 (0.32) | — | |
| SCHEMBL23046109 | 0.77 | KDM4E (0.40) | — | |
| SCHEMBL23811374 | 0.77 | — | — | |
| SCHEMBL21855869 | 0.77 | — | — | |
| SCHEMBL21855977 | 0.77 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4506035-A2 | SHP2 PHOSPHATASE INHIBITORS AND METHODS OF USE THEREOF | Relay Therapeutics, Inc. (US) | 2025-02-12 | — | — | EP | disclosed |
| CN-117263942-A | SHP2 phosphatase inhibitors and methods of use thereof | 传达治疗有限公司 | 2023-12-22 | — | — | CN | disclosed |
| CN-112166110-B | SHP2 phosphatase inhibitors and methods of use thereof | 传达治疗有限公司 | 2023-08-11 | — | — | CN | disclosed |