⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6751378 | 0.99 | — | — | |
| SCHEMBL6749776 | 0.80 | S1PR1 (0.30) | — | |
| SCHEMBL4863163 | 0.78 | L3MBTL1 (0.31) | — | |
| SCHEMBL4871997 | 0.77 | L3MBTL1 (0.43) | — | |
| SCHEMBL4868253 | 0.76 | APP (0.33) | — | |
| SCHEMBL9706404 | 0.74 | THRA (0.43) | — | |
| SCHEMBL9710301 | 0.74 | THRA (0.43) | — | |
| SCHEMBL9317819 | 0.74 | THRA (0.43) | — | |
| SCHEMBL9710358 | 0.74 | THRA (0.43) | — | |
| SCHEMBL9706437 | 0.74 | THRA (0.43) | — |
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-6703082-B1 | VARIOUS NAPHTHALENE-CONTAINING LIQUID CRYSTALS | DISPLAYTECH, INC. | 2004-03-09 | — | — | US | disclosed |