⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL24256512 | 0.78 | CHRM2 (0.34) | — | |
| SCHEMBL11479438 | 0.77 | ALDH1A1 (0.35) | — | |
| SCHEMBL5543091 | 0.77 | MEN1 (0.32) | — | |
| SCHEMBL22868175 | 0.72 | RIPK1 (0.31) | — | |
| SCHEMBL11655814 | 0.72 | — | — | |
| SCHEMBL24507340 | 0.72 | — | — | |
| SCHEMBL12591096 | 0.69 | ALDH1A1 (0.32) | — | |
| SCHEMBL14372153 | 0.69 | RIPK1 (0.44) | — | |
| SCHEMBL25672318 | 0.69 | — | — | |
| SCHEMBL10116483 | 0.67 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20200115354-A1 | THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF | GENENTECH, INC. (US) | 2020-04-16 | — | — | US | disclosed |
| US-10457654-B2 | Therapeutic compounds and methods of use thereof | GENENTECH, INC. (US) | 2019-10-29 | — | — | US | disclosed |
| US-20180105504-A1 | THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF | GENENTECH, INC. (US) | 2018-04-19 | — | — | US | disclosed |
| US-20180105504-A1 | THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF | GENENTECH, INC. (US) | 2018-04-19 | — | — | US | disclosed |