⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL786364 | 0.78 | TDP1 (0.33) | — | |
| SCHEMBL18948421 | 0.72 | — | — | |
| SCHEMBL22314805 | 0.67 | ADRB2 (0.39) | — | |
| SCHEMBL18889865 | 0.67 | — | — | |
| SCHEMBL18412747 | 0.67 | — | — | |
| SCHEMBL13187442 | 0.67 | — | — | |
| SCHEMBL13354833 | 0.67 | — | — | |
| SCHEMBL4761226 | 0.65 | — | — | |
| SCHEMBL10028335 | 0.64 | LMNA (0.46) | — | |
| SCHEMBL24218378 | 0.63 | — | — |
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-20210276987-A1 | PHARMACEUTICAL AGENTS FOR USE IN SMOKING AND TOBACCO CESSATION | WASHINGTON STATE UNIVERSITY (US) | 2021-09-09 | — | — | US | disclosed |
| US-11084811-B2 | Compounds for treatment of cancer | Oncternal Therapeutics, Inc. (US) | 2021-08-10 | — | — | US | disclosed |
| US-20180170918-A1 | METHODS OF SYNTHESIZING A DIFLUOROLACTAM ANALOG | CAYMAN CHEMICAL CO INC (US) | 2018-06-21 | — | — | US | disclosed |
| EP-2980875-A1 | ORGANIC THIN-FILM TRANSISTOR | FUJIFILM Corporation (JP) | 2016-02-03 | — | — | EP | disclosed |