⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1005721 | 0.82 | — | — | |
| SCHEMBL516848 | 0.82 | — | — | |
| SCHEMBL516849 | 0.82 | — | — | |
| Hydrochloric Acid SCHEMBL1317097 | 0.80 | — | — | |
| Bromide SCHEMBL1831534 | 0.80 | — | — | |
| Bromide SCHEMBL1831532 | 0.80 | — | — | |
| Hydrochloric Acid SCHEMBL19285480 | 0.80 | — | — | |
| Hydrochloric Acid SCHEMBL6133053 | 0.80 | — | — | |
| SCHEMBL15496994 | 0.79 | — | — | |
| SCHEMBL7426486 | 0.78 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-10766877-B2 | Melanocortin subtype-2 receptor (MC2R) antagonists and uses thereof | Crinetics Pharmaceuticals, Inc. (US) | 2020-09-08 | — | — | US | disclosed |