⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12413121 | 0.92 | LMNA (0.31) | — | |
| SCHEMBL12413111 | 0.89 | HSD17B10 (0.30) | — | |
| SCHEMBL12413113 | 0.88 | — | — | |
| SCHEMBL12412820 | 0.88 | PKM (0.34) | — | |
| SCHEMBL12413102 | 0.87 | HSD17B10 (0.30) | — | |
| SCHEMBL12462947 | 0.86 | USP14 (0.31) | — | |
| SCHEMBL12413127 | 0.84 | HSD17B10 (0.33) | — | |
| SCHEMBL12413109 | 0.83 | NPC1 (0.32) | — | |
| SCHEMBL12413108 | 0.82 | HSD17B10 (0.31) | — | |
| SCHEMBL12413099 | 0.81 | HRH4 (0.34) | — |
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-20110166362-A1 | NOVEL COMPOUND AND ORGANIC SEMICONDUCTOR MATERIAL | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2011-07-07 | — | — | US | disclosed |
| US-20110166362-A1 | NOVEL COMPOUND AND ORGANIC SEMICONDUCTOR MATERIAL | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2011-07-07 | — | — | US | disclosed |