Predicted protein targets (top 2)
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 | |
|---|---|---|---|---|
| SCHEMBL8969597 | 0.92 | TACR2 (0.53) | TACR2TACR1 | |
| Water SCHEMBL8559085 | 0.88 | TACR1 (0.48) | TACR2TACR1 | |
| SCHEMBL8562105 | 0.85 | TACR1 (0.54) | TACR2TACR1 | |
| SCHEMBL8564434 | 0.82 | TACR1 (0.51) | TACR2TACR1 | |
| Nolpitantium SCHEMBL29388081 | 0.80 | TACR2 (0.62) | TACR2TACR1 | |
| Nolpitantium SCHEMBL6350205 | 0.80 | TACR2 (0.62) | TACR2TACR1 | |
| Nolpitantium SCHEMBL2142512 | 0.80 | TACR2 (0.62) | TACR2TACR1 | |
| Nolpitantium SCHEMBL1650319 | 0.80 | TACR2 (0.61) | TACR2TACR1 | |
| Nolpitantium SCHEMBL29405138 | 0.80 | TACR2 (0.61) | TACR2TACR1 | |
| Nolpitantium SCHEMBL7561842 | 0.80 | TACR2 (0.61) | TACR2TACR1 |
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-0700386-A1 | NEUROKININ RECEPTOR ANTAGONISTS | SANOFI (FR) | 1996-03-13 | — | — | EP | claimed |
| WO-1995026338-A1 | NEUROKININ RECEPTOR ANTAGONISTS | SANOFI (FR) | 1995-10-05 | — | — | WO | claimed |
| EP-0700386-A1 | NEUROKININ RECEPTOR ANTAGONISTS | SANOFI (FR) | 1996-03-13 | — | — | EP | disclosed |
| WO-1995026338-A1 | NEUROKININ RECEPTOR ANTAGONISTS | SANOFI (FR) | 1995-10-05 | — | — | WO | disclosed |