⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1477929 | 0.59 | CES2 (0.30) | — | |
| SCHEMBL2494425 | 0.59 | — | — | |
| SCHEMBL1826218 | 0.59 | CYP1A2 (0.32) | — | |
| SCHEMBL2961120 | 0.58 | — | — | |
| SCHEMBL18330473 | 0.58 | KDM4E (0.45) | — | |
| SCHEMBL302728 | 0.57 | — | — | |
| SCHEMBL22223887 | 0.55 | TDP1 (0.31) | — | |
| SCHEMBL6662462 | 0.55 | — | — | |
| Hydrochloric Acid SCHEMBL7039943 | 0.55 | — | — | |
| SCHEMBL6911502 | 0.55 | MAOB (0.30) | — |
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-9929345-B1 | Curable polymeric materials and their use for fabricating electronic devices | FLEXTERRA, INC. (US) | 2018-03-27 | — | — | US | disclosed |