⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL459903 | 0.77 | — | — | |
| SCHEMBL3626628 | 0.76 | — | — | |
| SCHEMBL13544222 | 0.76 | TSHR (0.30) | — | |
| SCHEMBL17694848 | 0.74 | — | — | |
| SCHEMBL11393050 | 0.74 | — | — | |
| SCHEMBL24777650 | 0.74 | — | — | |
| SCHEMBL28196450 | 0.74 | MEN1 (0.30) | — | |
| SCHEMBL5681862 | 0.73 | MEN1 (0.32) | — | |
| SCHEMBL12314821 | 0.72 | — | — | |
| SCHEMBL8200858 | 0.71 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022016309-A1 | METHODS FOR PREPARING SUBSTITUTED CHROMANONE DERIVATIVES | HANGZHOU DUYI TECHNOLOGY CO. LTD. (CN) | 2022-01-27 | — | — | WO | disclosed |
| WO-2010036427-A1 | CATIONIC STEROID ANTIMICROBIAL DIAGNOSTIC, DETECTION, SCREENING AND IMAGING METHODS | BRIGHAM YOUNG UNIVERSITY (US) | 2010-04-01 | — | — | WO | disclosed |