⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL56456 | 0.72 | — | — | |
| SCHEMBL7067005 | 0.72 | — | — | |
| SCHEMBL1993615 | 0.72 | TSHR (0.43) | — | |
| SCHEMBL8897968 | 0.72 | TSHR (0.43) | — | |
| SCHEMBL7190344 | 0.71 | TSHR (0.35) | — | |
| Bromide SCHEMBL28675956 | 0.69 | — | — | |
| Ammonia Solution, Strong SCHEMBL11498771 | 0.69 | TSHR (0.40) | — | |
| Charcoal, Activated SCHEMBL8892440 | 0.69 | — | — | |
| SCHEMBL5530424 | 0.69 | TSHR (0.40) | — | |
| SCHEMBL27781294 | 0.69 | TSHR (0.40) | — |
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 |
|---|---|---|---|---|---|---|---|
| JP-10256276-A | — | — | None | — | — | JP | disclosed |
| JP-H10256276-A | FORMATION OF P-TYPE II-VI COMPOUND SEMICONDUCTOR | SHOWA DENKO KK | 1998-09-25 | — | — | JP | disclosed |