⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22384551 | 0.77 | — | — | |
| SCHEMBL4600954 | 0.77 | EPHX1 (0.31) | — | |
| SCHEMBL2563480 | 0.77 | — | — | |
| SCHEMBL502573 | 0.71 | — | — | |
| SCHEMBL29463718 | 0.71 | — | — | |
| SCHEMBL3672447 | 0.71 | — | — | |
| SCHEMBL18495004 | 0.69 | CETP (0.32) | — | |
| SCHEMBL3271650 | 0.69 | CYP2C19 (0.45) | — | |
| SCHEMBL4445315 | 0.68 | — | — | |
| SCHEMBL17495568 | 0.68 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-112601736-B | Compound, colored resin composition, color filter and display device | 东友精细化工有限公司 | 2023-12-08 | — | — | CN | disclosed |
| CN-112601736-A | Compound, colored resin composition, color filter and display device | 东友精细化工有限公司 | 2021-04-02 | — | — | CN | disclosed |
| US-6602830-B1 | Tractions fluids having excellent low temperature properties | DOW CORNING CORPORATION | 2003-08-05 | — | — | US | disclosed |