⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19726586 | 1.00 | — | — | |
| SCHEMBL18367599 | 0.88 | MAP3K12 (0.32) | — | |
| SCHEMBL18367601 | 0.88 | MAP3K12 (0.32) | — | |
| SCHEMBL18367605 | 0.82 | — | — | |
| SCHEMBL18367661 | 0.80 | RET (0.36) | — | |
| SCHEMBL19732432 | 0.80 | KDM5A (0.34) | — | |
| SCHEMBL18377725 | 0.80 | KDM5A (0.34) | — | |
| SCHEMBL18367634 | 0.78 | DRD2 (0.33) | — | |
| SCHEMBL19589358 | 0.76 | HRH4 (0.31) | — | |
| SCHEMBL19589365 | 0.76 | HRH4 (0.31) | — |
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-9815818-B2 | Cot modulators and methods of use thereof | GILEAD SCIENCES, INC. (US) | 2017-11-14 | — | — | US | disclosed |
| US-9815818-B2 | Cot modulators and methods of use thereof | GILEAD SCIENCES, INC. (US) | 2017-11-14 | — | — | US | disclosed |
| US-20170008873-A1 | COT MODULATORS AND METHODS OF USE THEREOF | GILEAD SCIENCES, INC. | 2017-01-12 | — | — | US | disclosed |