⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28394355 | 0.64 | — | — | |
| SCHEMBL1402625 | 0.63 | — | — | |
| SCHEMBL332941 | 0.60 | — | — | |
| SCHEMBL459710 | 0.59 | — | — | |
| SCHEMBL21753880 | 0.57 | — | — | |
| SCHEMBL15254360 | 0.57 | — | — | |
| SCHEMBL5180559 | 0.55 | — | — | |
| SCHEMBL28524647 | 0.55 | — | — | |
| SCHEMBL28368959 | 0.55 | — | — | |
| SCHEMBL28368956 | 0.55 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113518791-B | Storage-stable pigment-containing isocyanate-group-containing formulations having an isocyanate-group-containing grinding resin and use thereof | 科思创知识产权两合公司 | 2023-08-08 | — | — | CN | disclosed |
| CN-110337459-B | Reaction mixtures of isocyanates and polyols having extended pot lives | 科思创德国股份有限公司 | 2022-09-06 | — | — | CN | disclosed |
| CN-112020528-B | Storage-stable, pigmented, isocyanate group-containing formulations and use thereof | 科思创知识产权两合公司 | 2022-08-30 | — | — | CN | disclosed |
| CN-113518791-A | Storage-stable, pigment-containing formulations containing isocyanate groups with abrasive resins containing isocyanate groups and use thereof | 科思创知识产权两合公司 | 2021-10-19 | — | — | CN | disclosed |
| CN-112020528-A | Storage-stable, pigmented, isocyanate group-containing formulations and use thereof | 科思创知识产权两合公司 | 2020-12-01 | — | — | CN | disclosed |