⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9713104 | 0.75 | TSHR (0.33) | — | |
| SCHEMBL15380982 | 0.72 | — | — | |
| SCHEMBL22326647 | 0.70 | — | — | |
| SCHEMBL765917 | 0.65 | DPP4 (0.35) | — | |
| SCHEMBL20224768 | 0.65 | DPP4 (0.35) | — | |
| SCHEMBL14419674 | 0.65 | — | — | |
| SCHEMBL24477535 | 0.65 | — | — | |
| SCHEMBL1991399 | 0.65 | — | — | |
| SCHEMBL17729883 | 0.65 | — | — | |
| SCHEMBL435431 | 0.65 | ALDH1A1 (0.30) | — |
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-11566015-B2 | Melanocortin subtype-2 receptor (MC2R) antagonists and uses thereof | Crinetics Pharmaceuticals, Inc. (US) | 2023-01-31 | — | — | US | disclosed |
| US-20210238164-A1 | MELANOCORTIN SUBTYPE-2 RECEPTOR (MC2R) ANTAGONISTS AND USES THEREOF | Crinetics Pharmaceuticals, Inc. | 2021-08-05 | — | — | US | disclosed |