Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.48 |
| ▸ | ABCB1 | P08183 | 16/20 | 0.44 |
| ▸ | ABCC9 | O60706 | 3/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL9298594 | 1.00 | CYP3A4 (0.48) | CYP3A4ALOX15ABCB1ABCC9 | |
| SCHEMBL9298591 | 1.00 | CYP3A4 (0.48) | CYP3A4ALOX15ABCB1ABCC9 | |
| SCHEMBL9300563 | 0.91 | ABCB1 (0.52) | CYP3A4ALOX15ABCB1ABCC9 | |
| SCHEMBL9300566 | 0.91 | ABCB1 (0.52) | CYP3A4ALOX15ABCB1ABCC9 | |
| SCHEMBL9300570 | 0.91 | ABCB1 (0.52) | CYP3A4ALOX15ABCB1ABCC9 | |
| SCHEMBL9299947 | 0.88 | CYP3A4 (0.44) | CYP3A4ALOX15ABCB1ABCC9 | |
| SCHEMBL9299953 | 0.88 | CYP3A4 (0.44) | CYP3A4ALOX15ABCB1ABCC9 | |
| SCHEMBL9299943 | 0.88 | CYP3A4 (0.44) | CYP3A4ALOX15ABCB1ABCC9 | |
| SCHEMBL9300713 | 0.87 | CYP3A4 (0.52) | CYP3A4ALOX15ABCB1ABCC9 | |
| SCHEMBL9300702 | 0.87 | CYP3A4 (0.52) | CYP3A4ALOX15ABCB1ABCC9 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5296492-A | Certain chroman derivatives useful for treating symptoms caused by contraction of smooth muscles, circulatory diseases or epilepsy | NIPPON KAYAKU KABUSHIKI KAISHA (JP) | 1994-03-22 | — | — | US | disclosed |
| EP-0518342-A1 | Chroman derivatives | Nippon Kayaku Kabushiki Kaisha (JP) | 1992-12-16 | — | — | EP | disclosed |