⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21093218 | 0.88 | DOT1L (0.33) | — | |
| SCHEMBL1712693 | 0.78 | — | — | |
| SCHEMBL24615140 | 0.78 | — | — | |
| SCHEMBL21936183 | 0.78 | — | — | |
| SCHEMBL21069201 | 0.78 | — | — | |
| SCHEMBL21936216 | 0.78 | — | — | |
| SCHEMBL21936392 | 0.78 | KCNH2 (0.34) | — | |
| SCHEMBL25103819 | 0.75 | ALDH1A1 (0.37) | — | |
| SCHEMBL595579 | 0.70 | — | — | |
| SCHEMBL21259499 | 0.70 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3381896-B1 | BIPHENYL COMPOUND OR SALT THEREOF | TAIHO PHARMACEUTICAL CO LTD (JP) | 2023-01-18 | — | — | EP | disclosed |
| EP-3633380-A1 | METHOD FOR PREDICTING THERAPEUTIC EFFECT OF LSD1 INHIBITOR BASED ON EXPRESSION OF INSM1 | Taiho Pharmaceutical Co., Ltd. (JP) | 2020-04-08 | — | — | EP | disclosed |