⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL703879 | 0.91 | TSHR (0.32) | — | |
| SCHEMBL13089454 | 0.90 | — | — | |
| SCHEMBL707187 | 0.88 | TSHR (0.32) | — | |
| SCHEMBL704437 | 0.84 | TSHR (0.33) | — | |
| SCHEMBL703612 | 0.83 | LTA4H (0.34) | — | |
| SCHEMBL15643179 | 0.81 | HRH1 (0.36) | — | |
| SCHEMBL27710208 | 0.81 | MGAM (0.33) | — | |
| SCHEMBL13089336 | 0.81 | ESR1 (0.31) | — | |
| SCHEMBL705467 | 0.79 | TSHR (0.31) | — | |
| SCHEMBL27730774 | 0.77 | NPSR1 (0.30) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20100261925-A1 | METHOD FOR PRODUCING SILICON COMPOUND | JSR CORPORATION (JP) | 2010-10-14 | — | — | US | disclosed |