⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6707811 | 1.00 | — | — | |
| SCHEMBL10537908 | 1.00 | — | — | |
| SCHEMBL10537870 | 0.85 | ALDH1A1 (0.64) | — | |
| SCHEMBL10540928 | 0.85 | ALDH1A1 (0.64) | — | |
| SCHEMBL215200 | 0.80 | — | — | |
| SCHEMBL14761689 | 0.79 | ALDH1A1 (0.37) | — | |
| SCHEMBL17732229 | 0.76 | — | — | |
| SCHEMBL17891668 | 0.76 | — | — | |
| SCHEMBL23023153 | 0.76 | ALDH1A1 (0.48) | — | |
| SCHEMBL10541941 | 0.76 | ALDH1A1 (0.48) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20170042906-A1 | FATTY ACID CONJUGATES OF QUETIAPINE, PROCESS FOR MAKING AND USING THE SAME | ALTER DOMUS (US) LLC | 2017-02-16 | — | — | US | disclosed |
| US-9511149-B2 | Fatty acid conjugates of quetiapine, process for making and using the same | KEMPHARM, INC. (US) | 2016-12-06 | — | — | US | disclosed |
| US-20150044261-A1 | Fatty Acid Conjugates of Quetiapine, Process for Making and Using the Same | ALTER DOMUS (US) LLC | 2015-02-12 | — | — | US | disclosed |
| US-8900604-B2 | Fatty acid conjugates of quetiapine, process for making and using the same | KEMPHARM, INC. (US) | 2014-12-02 | — | — | US | disclosed |
| US-20130045247-A1 | FATTY ACID CONJUGATES OF QUETIAPINE, PROCESS FOR MAKING AND USING THE SAME | KEMPHARM INC. | 2013-02-21 | — | — | US | disclosed |
| EP-0719294-A1 | A NEW CATALYST FOR RING-OPENING METATHESIS POLYMERIZATION | EXXON CHEMICAL PATENTS INC. (US) | 1996-07-03 | — | — | EP | disclosed |
| WO-1995001388-A1 | A NEW CATALYST FOR RING-OPENING METATHESIS POLYMERIZATION | EXXON CHEMICAL PATENTS INC. (US) | 1995-01-12 | — | — | WO | disclosed |