⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2942956 | 1.00 | — | — | |
| SCHEMBL11309249 | 1.00 | — | — | |
| SCHEMBL20937510 | 0.87 | — | — | |
| SCHEMBL13893516 | 0.87 | — | — | |
| SCHEMBL1270865 | 0.76 | TSHR (0.30) | — | |
| SCHEMBL1270866 | 0.76 | TSHR (0.30) | — | |
| SCHEMBL21299289 | 0.76 | — | — | |
| SCHEMBL20460419 | 0.76 | — | — | |
| SCHEMBL19082598 | 0.76 | — | — | |
| SCHEMBL14540939 | 0.73 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-11008336-B2 | Compounds useful for inhibiting RORγt | ELI LILLY AND COMPANY (US) | 2021-05-18 | — | — | US | disclosed |
| US-20200048279-A1 | COMPOUNDS USEFUL FOR INHIBITING ROR-GAMMA-T | ELI LILLY AND COMPANY | 2020-02-13 | — | — | US | disclosed |
| EP-2595229-A2 | Composition, composite prepared from the composition, electrode using the composition or the composite, composite membrane including the composite, and fuel cell including the composite membrane | Samsung Electronics Co., Ltd (KR) | 2013-05-22 | — | — | EP | disclosed |