Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACACB | O00763 | 19/20 | 1.00 |
| ▸ | MEN1 | O00255 | 1/20 | 0.59 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.59 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
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 | |
|---|---|---|---|---|
| SCHEMBL12001248 | 0.91 | ACACB (0.83) | ACACBMEN1KMT2A | |
| SCHEMBL255731 | 0.91 | ACACB (1.00) | ACACB | |
| SCHEMBL256113 | 0.84 | ACACB (1.00) | ACACB | |
| SCHEMBL12001265 | 0.82 | ACACB (0.76) | ACACBMEN1KMT2A | |
| SCHEMBL24230211 | 0.81 | KMT2A (0.73) | ACACBMEN1KMT2A | |
| SCHEMBL256276 | 0.79 | ACACB (1.00) | ACACB | |
| SCHEMBL25217118 | 0.79 | KMT2A (0.73) | ACACBMEN1KMT2A | |
| SCHEMBL25213967 | 0.79 | KMT2A (0.73) | ACACBMEN1KMT2A | |
| SCHEMBL25268096 | 0.79 | KMT2A (0.73) | ACACBMEN1KMT2A | |
| SCHEMBL16063362 | 0.79 | ACACB (1.00) | ACACB |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2611771-B1 | SUBSTITUTED HETEROARYL- AND ARYLALKYNYL BENZENE DERIVATIVES AS ACC-INHIBITORS FOR THE TREATMENT OF METABOLIC DISEASES | BOEHRINGER INGELHEIM INT (DE) | 2016-11-23 | — | — | EP | disclosed |
| US-8835472-B2 | Compounds, pharmaceutical compositions and uses thereof | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2014-09-16 | — | — | US | disclosed |
| WO-2012028676-A1 | NEW COMPOUNDS, PHARMACEUTICAL COMPOSITIONS AND USES THEREOF | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2012-03-08 | — | — | WO | disclosed |