⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3724208 | 0.86 | CES1 (0.44) | — | |
| SCHEMBL678576 | 0.82 | KMT2A (0.52) | — | |
| SCHEMBL10603115 | 0.82 | KMT2A (0.52) | — | |
| SCHEMBL2227135 | 0.82 | KMT2A (0.52) | — | |
| SCHEMBL16782312 | 0.82 | KMT2A (0.52) | — | |
| Fluoride SCHEMBL2400392 | 0.81 | KMT2A (0.50) | — | |
| SCHEMBL8778754 | 0.79 | — | — | |
| SCHEMBL21662481 | 0.77 | — | — | |
| SCHEMBL25660423 | 0.76 | GRIK1 (0.50) | — | |
| SCHEMBL25661100 | 0.76 | GRIK1 (0.50) | — |
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-2285937-A1 | METHODS FOR BREAKING CRUDE OIL AND WATER EMULSIONS | General Electric Company (US) | 2011-02-23 | — | — | EP | disclosed |
| US-20090197978-A1 | METHODS FOR BREAKING CRUDE OIL AND WATER EMULSIONS | GENERAL ELECTRIC COMPANY | 2009-08-06 | — | — | US | disclosed |
| WO-2009097061-A1 | METHODS FOR BREAKING CRUDE OIL AND WATER EMULSIONS | GENERAL ELECTRIC COMPANY (US) | 2009-08-06 | — | — | WO | disclosed |
| EP-1758468-A1 | TASTE IMPROVING SUBSTANCES | Quest International Services B.V. (NL) | 2007-03-07 | — | — | EP | disclosed |
| WO-2005102071-A1 | TASTE IMPROVING SUBSTANCES | QUEST INTERNATIONAL SERVICES B.V. (NL) | 2005-11-03 | — | — | WO | disclosed |
| EP-0337350-B1 | USE OF DIMETHYLHEPTYLPHENYL BUTANOYL ETHANOLAMINE IN TREATMENT OF HYPERURICEMIA | Eisai Co., Ltd. (JP) | 1993-07-07 | — | — | EP | disclosed |
| EP-0337350-A3 | USE OF DIMETHYLHEPTYLPHENYL BUTANOYL ETHANOLAMINE IN TREATMENT OF HYPERURICEMIA | Eisai Co., Ltd. (JP) | 1991-01-16 | — | — | EP | disclosed |