⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL141619 | 0.95 | — | — | |
| SCHEMBL9064034 | 0.95 | — | — | |
| SCHEMBL890359 | 0.95 | — | — | |
| Carbamic Acid SCHEMBL11590147 | 0.81 | — | — | |
| Acetic Acid SCHEMBL10490042 | 0.81 | FFAR3 (0.50) | — | |
| Ammonia Solution, Strong SCHEMBL2316867 | 0.76 | — | — | |
| SCHEMBL28788283 | 0.71 | BLM (0.33) | — | |
| SCHEMBL516224 | 0.70 | — | — | |
| Ammonia Solution, Strong SCHEMBL902203 | 0.70 | — | — | |
| SCHEMBL3953424 | 0.70 | — | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4356275-A | Aminoplast foams | BAYER AKTIENGESELLSCHAFT (DE) | 1982-10-26 | — | — | US | disclosed |
| US-4282135-A | Aminoplast dispersions and polyurethanes prepared therefrom | BAYER AKTIENGESELLSCHAFT (DE) | 1981-08-04 | — | — | US | disclosed |
| US-4225481-A | Aminoplast dispersions and polyurethanes prepared therefrom | BAYER AKTIENGESELLSCHAFT (DE) | 1980-09-30 | — | — | US | disclosed |
| US-4122049-A | Process for the production of polyurethane foam | BAYER AKTIENGESELLSCHAFT (DE) | 1978-10-24 | — | — | US | disclosed |
| US-4028306-A | COATINGS | BAYER AKTIENGESELLSCHAFT (DT) | 1977-06-07 | — | — | US | disclosed |
| US-3931112-A | POLYURETHANE | BAYER AKTIENGESELLSCHAFT (DT) | 1976-01-06 | — | — | US | disclosed |