Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 20/20 | 0.67 |
| ▸ | S1PR3 | Q99500 | 15/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.47 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL1808321 | 0.87 | S1PR1 (0.63) | S1PR1S1PR3CYP3A4CYP2C8KCNH2 | |
| SCHEMBL1804809 | 0.87 | S1PR1 (0.65) | S1PR1S1PR3CYP3A4CYP2C8KCNH2 | |
| SCHEMBL21370002 | 0.86 | S1PR1 (0.64) | S1PR1S1PR3CYP3A4CYP2C8KCNH2 | |
| SCHEMBL21369985 | 0.83 | S1PR1 (0.61) | S1PR1S1PR3CYP3A4CYP2C8KCNH2 | |
| SCHEMBL1807240 | 0.81 | S1PR1 (1.00) | S1PR1S1PR3CYP3A4CYP2C8KCNH2 | |
| SCHEMBL1813229 | 0.79 | S1PR1 (0.63) | S1PR1S1PR3CYP3A4CYP2C8KCNH2 | |
| SCHEMBL1810153 | 0.79 | S1PR1 (0.65) | S1PR1S1PR3CYP3A4CYP2C8KCNH2 | |
| SCHEMBL1812141 | 0.73 | S1PR1 (1.00) | S1PR1S1PR3CYP3A4CYP2C8KCNH2 | |
| SCHEMBL1813913 | 0.73 | S1PR1 (0.61) | S1PR1S1PR3CYP3A4CYP2C8KCNH2 | |
| SCHEMBL1814457 | 0.73 | S1PR1 (0.61) | S1PR1S1PR3CYP3A4CYP2C8KCNH2 |
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-2592071-B1 | Tricyclic heterocyclic compounds | BRISTOL MYERS SQUIBB CO (US) | 2019-09-18 | — | — | EP | disclosed |