⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL468002 | 0.97 | — | — | |
| Water SCHEMBL2877037 | 0.94 | — | — | |
| Bromide SCHEMBL30721655 | 0.94 | — | — | |
| Hydrochloric Acid SCHEMBL5383422 | 0.94 | — | — | |
| SCHEMBL21216247 | 0.92 | ADH1B (0.36) | — | |
| Dimethylamine SCHEMBL7154727 | 0.92 | ADH1B (0.36) | — | |
| SCHEMBL11667725 | 0.87 | KDM1A (0.44) | — | |
| Trimethylammonium SCHEMBL29196102 | 0.87 | KDM1A (0.33) | — | |
| Allylamine SCHEMBL10873683 | 0.85 | ALDH1A1 (0.41) | — | |
| Bicarbonate SCHEMBL7051130 | 0.85 | FAAH (0.41) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6300305-B1 | BOOSTING DETERGENTS BY MIXING WITH AMINES FOR FABRICS | BASF AKTIENGESELLSCHAFT (DE) | 2001-10-09 | — | — | US | claimed |
| US-6331519-B1 | MIXING POLYETHYLENIMINE FORMED BY PARTIAL HYDROLYSIS OF OLIGO/POLYVINYLFORMAMIDES WITH DI- OR POLYCARBOXYLIC ACID OR SALT; COLOR TEXTILES, COTTON | BASF AKTIENGESELLSCHAFT (DE) | 2001-12-18 | — | — | US | disclosed |
| US-6300305-B1 | BOOSTING DETERGENTS BY MIXING WITH AMINES FOR FABRICS | BASF AKTIENGESELLSCHAFT (DE) | 2001-10-09 | — | — | US | disclosed |
| US-6180590-B1 | USE OF A CYCLOPOLYAMINE AS DETERGENCY BOOSTER, PREFERABLY IN TEXTILE DETERGENTS, ESPECIALLY IN COLOR DETERGENTS | BASF AKTIENGESELLSCHAFT (DE) | 2001-01-30 | — | — | US | disclosed |