⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12441774 | 0.77 | MAPT (0.35) | — | |
| SCHEMBL29793430 | 0.77 | ALDH1A1 (0.37) | — | |
| SCHEMBL1187005 | 0.76 | — | — | |
| SCHEMBL7810661 | 0.75 | — | — | |
| SCHEMBL3188625 | 0.74 | — | — | |
| SCHEMBL3187131 | 0.74 | — | — | |
| SCHEMBL9762556 | 0.74 | — | — | |
| SCHEMBL28809178 | 0.71 | — | — | |
| SCHEMBL9516078 | 0.71 | MAPT (0.32) | — | |
| SCHEMBL11819567 | 0.71 | MAPT (0.32) | — |
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-12613191-B2 | Multiplexed Raman molecular imaging | UNIVERSITY OF SOUTHERN CALIFORNIA (US) | 2026-04-28 | — | — | US | disclosed |
| US-20240085335-A1 | MULTIPLEXED RAMAN MOLECULAR IMAGING | UNIVERSITY OF SOUTHERN CALIFORNIA | 2024-03-14 | — | — | US | disclosed |
| WO-2022157674-A1 | MULTIPLEXED RAMAN MOLECULAR IMAGING | UNIVERSITY OF SOUTHERN CALIFORNIA (US) | 2022-07-28 | — | — | WO | disclosed |
| US-3992397-A | (1-Alkyl-5-nitro-imidazolyl-2-alkyl)-heteroaryl compounds and process for their manufacture | HOECHST AKTIENGESELLSCHAFT (DT) | 1976-11-16 | — | — | US | disclosed |