⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16330579 | 0.85 | TSHR (0.30) | — | |
| SCHEMBL13907086 | 0.82 | PSMB8 (0.30) | — | |
| SCHEMBL15059308 | 0.82 | — | — | |
| SCHEMBL31529657 | 0.82 | — | — | |
| SCHEMBL17776322 | 0.82 | PSMB8 (0.32) | — | |
| SCHEMBL17776321 | 0.82 | PSMB8 (0.32) | — | |
| SCHEMBL19658254 | 0.82 | PSMB8 (0.32) | — | |
| SCHEMBL19658247 | 0.82 | PSMB8 (0.32) | — | |
| SCHEMBL17776273 | 0.82 | PSMB8 (0.32) | — | |
| SCHEMBL410465 | 0.82 | PSMB8 (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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8952147-B2 | Conjugates, preparation thereof, and therapeutic use thereof | SANOFI (FR) | 2015-02-10 | — | — | US | disclosed |
| US-20120225089-A1 | NOVEL CONJUGATES, PREPARATION THEREOF, AND THERAPEUTIC USE THEREOF | SANOFI (FR) | 2012-09-06 | — | — | US | disclosed |