⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8412619 | 0.85 | — | — | |
| SCHEMBL8414236 | 0.85 | — | — | |
| SCHEMBL8414149 | 0.83 | — | — | |
| SCHEMBL8410340 | 0.81 | — | — | |
| SCHEMBL13908374 | 0.77 | FAAH (0.35) | — | |
| SCHEMBL19770805 | 0.76 | FDPS (0.32) | — | |
| SCHEMBL8414193 | 0.76 | MLYCD (0.32) | — | |
| SCHEMBL8413327 | 0.76 | MLYCD (0.32) | — | |
| SCHEMBL8114663 | 0.74 | ARG1 (0.33) | — | |
| SCHEMBL453783 | 0.74 | CES2 (0.41) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0690049-B1 | Agent for treating hepato biliary diseases | R TECH UENO LTD (JP) | 1999-08-04 | — | — | EP | disclosed |
| US-5739161-A | PROSTAGLANDINS; DIARRHEA SIDE EFFECT REDUCTION | R-TECH UENO, LTD. (JP) | 1998-04-14 | — | — | US | disclosed |
| EP-0690049-A2 | Agent for treating hepato biliary diseases | R-TECH UENO LTD. (JP) | 1996-01-03 | — | — | EP | disclosed |