⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6414996 | 0.75 | — | — | |
| SCHEMBL8386363 | 0.72 | CA5A (0.36) | — | |
| SCHEMBL2848998 | 0.71 | — | — | |
| SCHEMBL6632490 | 0.69 | — | — | |
| SCHEMBL1156181 | 0.69 | — | — | |
| SCHEMBL1156182 | 0.69 | — | — | |
| SCHEMBL27569610 | 0.67 | — | — | |
| SCHEMBL26091835 | 0.67 | — | — | |
| SCHEMBL23681 | 0.67 | — | — | |
| SCHEMBL27526852 | 0.65 | — | — |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20030109741-A1 | Mixtures of semi-esters of polybasic organic acids and long-chain alkanols, the production and the use thereof | BASF AKTIENGESELLSCHAFT (DE) | 2003-06-12 | — | — | US | disclosed |
| US-5929283-A | HYDROXY AMINES; LOW IN IRRITATIVENESS TO THE SKIN AND HAIR AND EXCELLENT IN FOAMABILITY, AND CAN GIVE A PLEASANT FEELING TO THE USER'S SKIN | KAO CORPORATION (JP) | 1999-07-27 | — | — | US | disclosed |
| EP-0708079-B1 | 2-HYDROXYPROPANEDIAMINE DERIVATIVE AND DETERGENT COMPOSITION CONTAINING THE SAME | KAO CORP (JP) | 1999-04-14 | — | — | EP | disclosed |
| US-5801270-A | Amine derivative and detergent composition containing the same | KAO CORPORATION (JP) | 1998-09-01 | — | — | US | disclosed |
| EP-0740651-B1 | AMINE DERIVATIVE AND DETERGENT COMPOSITION CONTAINING THE SAME | KAO CORP (JP) | 1998-08-12 | — | — | EP | disclosed |
| US-5714457-A | LOW IN IRRITATIVENESS TO SKIN AND HAIR, EXCELLENT IN FOAMABILITY | KAO CORPORATION (JP) | 1998-02-03 | — | — | US | disclosed |
| EP-0740651-A1 | AMINE DERIVATIVE AND DETERGENT COMPOSITION CONTAINING THE SAME | Kao Corporation (JP) | 1996-11-06 | — | — | EP | disclosed |
| EP-0708079-A1 | 2-HYDROXYPROPANEDIAMINE DERIVATIVE AND DETERGENT COMPOSITION CONTAINING THE SAME | Kao Corporation (JP) | 1996-04-24 | — | — | EP | disclosed |
| WO-1995016664-A1 | AMINE DERIVATIVE AND DETERGENT COMPOSITION CONTAINING THE SAME | KAO CORPORATION (JP) | 1995-06-22 | — | — | WO | disclosed |
| US-4001150-A | Composition for preparing electroconductive resin comprising an unsaturated polyester and phosphoric or sulfonic unsaturated ester | KANSAI PAINT COMPANY, LTD. (JA) | 1977-01-04 | — | — | US | disclosed |