⚠ 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 | |
|---|---|---|---|---|
| Acetic Acid SCHEMBL19350438 | 0.87 | FFAR3 (0.47) | — | |
| Acetic Acid SCHEMBL6280777 | 0.87 | — | — | |
| Acetic Acid SCHEMBL242246 | 0.87 | FFAR3 (0.47) | — | |
| Oxalic Acid SCHEMBL7607255 | 0.87 | SLC1A3 (0.44) | — | |
| Acetic Acid SCHEMBL10874504 | 0.87 | FFAR3 (0.47) | — | |
| Acetic Acid SCHEMBL5351332 | 0.84 | FFAR3 (0.44) | — | |
| Propionic Acid SCHEMBL30448445 | 0.84 | FFAR3 (0.62) | — | |
| Acetic Acid SCHEMBL9737099 | 0.84 | FFAR3 (0.44) | — | |
| Acetic Acid SCHEMBL9644947 | 0.84 | FFAR3 (0.44) | — | |
| Carbamic Acid SCHEMBL27969066 | 0.84 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5399339-A | Process for the preparation of nitride complexes of transition metals | CIS BIO INTERNATIONAL (FR) | 1995-03-21 | — | — | US | disclosed |
| EP-0136596-B1 | COVULCANIZABLE COMPOSITIONS OF FLUOROELASTOMERS BASED ON VINYLIDENE FLUORIDE AND TETRAFLUOROETHYLENE-PROPYLENE COPOLYMERS | AUSIMONT S.p.A. (IT) | 1988-05-11 | — | — | EP | disclosed |
| US-4530971-A | Containing an amino compound | MONTEDISON S.P.A. (IT) | 1985-07-23 | — | — | US | disclosed |
| EP-0136596-A2 | Covulcanizable compositions of fluoroelastomers based on vinylidene fluoride and tetrafluoroethylene-propylene copolymers | AUSIMONT S.p.A. (IT) | 1985-04-10 | — | — | EP | disclosed |