⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16506131 | 0.97 | — | — | |
| SCHEMBL7528731 | 0.83 | GABRR1 (0.43) | — | |
| SCHEMBL7509595 | 0.82 | — | — | |
| SCHEMBL874479 | 0.76 | — | — | |
| SCHEMBL4337585 | 0.76 | — | — | |
| SCHEMBL156431 | 0.72 | — | — | |
| SCHEMBL14459603 | 0.72 | — | — | |
| SCHEMBL6113253 | 0.72 | — | — | |
| SCHEMBL15681461 | 0.72 | — | — | |
| SCHEMBL847297 | 0.72 | — | — |
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-5814497-A | OBTAINING A RACEMIC PRODUCT, E.G. 2-HYDROXY DERIVATIVE FOR PRODUCING METHIONINE; BY-PRODUCT INHIBITION | RHONE-POULENC NUTRITION ANIMALE (FR) | 1998-09-29 | — | — | US | disclosed |