⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16891345 | 0.72 | — | — | |
| SCHEMBL3127451 | 0.67 | — | — | |
| SCHEMBL307826 | 0.64 | — | — | |
| SCHEMBL5207983 | 0.62 | — | — | |
| SCHEMBL14315391 | 0.62 | — | — | |
| SCHEMBL13329967 | 0.62 | — | — | |
| SCHEMBL991108 | 0.61 | — | — | |
| SCHEMBL247094 | 0.61 | — | — | |
| SCHEMBL247095 | 0.61 | — | — | |
| Ethyl Nitrite [Spirit] SCHEMBL5331030 | 0.61 | KMT2A (1.00) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2561352-B1 | GENETIC POLYMORPHISMS ASSOCIATED WITH STATIN RESPONSE AND CARDIOVASCULAR DISEASES, METHODS OF DETECTION AND USES THEREOF | CELERA CORP (US) | 2016-03-30 | — | — | EP | disclosed |
| US-9064521-B1 | Manufacturing of hard masks for patterning magnetic media | WD Media, LLC (US) | 2015-06-23 | — | — | US | disclosed |
| US-20140066592-A1 | METHODS AND COMPOSITIONS FOR THE TREATMENT OF CANCER OR OTHER DISEASES | CITY OF HOPE (US) | 2014-03-06 | — | — | US | disclosed |
| EP-2579697-A2 | Interposer, circuit board module, and method for manufacturing interposer | FUJITSU LIMITED (JP) | 2013-04-10 | — | — | EP | disclosed |