Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IL1B | P01584 | 13/20 | 0.46 |
| ▸ | NLRP3 | Q96P20 | 4/20 | 0.46 |
| ▸ | CCNK | O75909 | 1/20 | 0.45 |
| ▸ | CDK12 | Q9NYV4 | 1/20 | 0.45 |
| ▸ | KAT2B | Q92831 | 6/20 | 0.43 |
| ▸ | BPTF | Q12830 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL20145184 | 0.90 | IL1B (0.42) | IL1BNLRP3KAT2BBPTF | |
| SCHEMBL17031679 | 0.81 | HCRTR1 (0.49) | CCNKCDK12 | |
| SCHEMBL20144869 | 0.81 | IL1B (0.55) | IL1BNLRP3CCNKCDK12 | |
| SCHEMBL20145261 | 0.81 | IL1B (0.55) | IL1BNLRP3CCNKCDK12 | |
| SCHEMBL20145157 | 0.80 | KAT2B (0.52) | IL1BNLRP3CCNKCDK12KAT2B | |
| SCHEMBL20145210 | 0.76 | IL1B (0.49) | IL1BNLRP3CCNKCDK12KAT2B | |
| SCHEMBL20145228 | 0.73 | IL1B (0.54) | IL1BNLRP3CCNKCDK12KAT2B | |
| SCHEMBL20145188 | 0.73 | IL1B (0.43) | IL1BNLRP3CCNKCDK12 | |
| SCHEMBL22877139 | 0.73 | HCAR3 (0.45) | — | |
| SCHEMBL23292323 | 0.72 | CCNK (0.55) | CCNKCDK12 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2970207-B1 | SUBSTITUTED PIPERIDINE COMPOUNDS AND THEIR USE AS OREXIN RECEPTOR MODULATORS | JANSSEN PHARMACEUTICA NV (BE) | 2018-05-16 | — | — | EP | disclosed |