⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27657882 | 0.86 | — | — | |
| SCHEMBL10701373 | 0.80 | — | — | |
| SCHEMBL20898456 | 0.77 | — | — | |
| SCHEMBL29271178 | 0.76 | TSHR (0.33) | — | |
| SCHEMBL5155222 | 0.73 | HIF1A (0.32) | — | |
| SCHEMBL507805 | 0.73 | MGAM (0.33) | — | |
| SCHEMBL29270320 | 0.71 | MGAM (0.31) | — | |
| SCHEMBL1071160 | 0.71 | TSHR (0.41) | — | |
| Hydrochloric Acid SCHEMBL28390066 | 0.71 | MGAM (0.32) | — | |
| SCHEMBL709897 | 0.70 | TP53 (0.33) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2025036900-A1 | HAIR DYEING COMPOSITION | KAO CORPORATION (JP) | 2025-02-20 | — | — | WO | claimed |
| US-12491493-B1 | Amine appended bimetallic metal-organic framework (MOF-74) for carbon dioxide capture and method of preparation thereof | KING FAHD UNIVERSITY OF PETROLEUM AND MINERALS (SA) | 2025-12-09 | — | — | US | disclosed |
| WO-2025036900-A1 | HAIR DYEING COMPOSITION | KAO CORPORATION (JP) | 2025-02-20 | — | — | WO | disclosed |
| US-5691099-A | DISCOLORATION INHIBITION; PRESERVATION; IMAGE QUALITY | RICOH COMPANY, LTD. (JP) | 1997-11-25 | — | — | US | disclosed |