⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13503157 | 0.56 | — | — | |
| SCHEMBL3018569 | 0.54 | — | — | |
| SCHEMBL14496280 | 0.50 | — | — | |
| SCHEMBL2556305 | 0.45 | — | — | |
| SCHEMBL31598110 | 0.42 | ALDH1A1 (0.33) | — | |
| SCHEMBL795881 | 0.42 | ALDH1A1 (0.33) | — | |
| Isobutane SCHEMBL7754023 | 0.42 | TSHR (0.50) | — | |
| Isobutane SCHEMBL20490082 | 0.42 | TSHR (0.50) | — | |
| SCHEMBL29372284 | 0.42 | — | — | |
| Isobutane SCHEMBL768 | 0.42 | — | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0040288-B1 | COATING, IMPREGNATING AND ADHESIVE COMPOSITIONS | ROHM AND HAAS COMPANY (US) | 1984-11-14 | — | — | EP | disclosed |
| EP-0002801-B1 | COATING, IMPREGNATING AND ADHESIVE COMPOSITIONS, THEIR PREPARATION AND USE | ROHM AND HAAS COMPANY (US) | 1984-06-27 | — | — | EP | disclosed |
| US-4303563-A | ACRYLATE OR ACRYLAMIDE ALDIMINE OR KETIMINE DERIVATIVES | ROHM AND HAAS COMPANY, A CORP. OF DE. | 1981-12-01 | — | — | US | disclosed |
| EP-0040288-A1 | Coating, impregnating and adhesive compositions | ROHM AND HAAS COMPANY (US) | 1981-11-25 | — | — | EP | disclosed |
| US-4251597-A | ADDITION POLYMERS CONTAINING AMINE, ALDIMINE OR KETIMINE GROUPS AND AN ACRYLIC MONOMER | ROHM AND HAAS COMPANY (US) | 1981-02-17 | — | — | US | disclosed |
| US-4178292-A | Process for the preparation of oxaziridine | PRODUITS CHIMIQUES UGINE KUHLMANN (FR) | 1979-12-11 | — | — | US | disclosed |
| EP-0002801-A2 | Coating, impregnating and adhesive compositions, their preparation and use | ROHM AND HAAS COMPANY (US) | 1979-07-11 | — | — | EP | disclosed |