Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.46 |
| ▸ | ABCB1 | P08183 | 10/20 | 0.39 |
| ▸ | ABCC9 | O60706 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | PTGER1 | P34995 | 1/20 | 0.35 |
| ▸ | MAOB | P27338 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL9216559 | 0.71 | CYP3A4 (0.54) | CYP3A4ALOX15ABCB1ABCC9 | |
| SCHEMBL9737142 | 0.70 | MAOB (0.42) | CYP3A4ALOX15ABCB1GAAL3MBTL1 | |
| SCHEMBL9523872 | 0.67 | TDP1 (0.43) | CYP3A4ALOX15ABCB1ABCC9ALDH1A1 | |
| SCHEMBL9397793 | 0.65 | CYP3A4 (0.81) | CYP3A4ALOX15ABCB1 | |
| SCHEMBL9216547 | 0.65 | CYP3A4 (0.58) | CYP3A4ALOX15ABCB1ABCC9 | |
| SCHEMBL9216538 | 0.65 | CYP3A4 (0.58) | CYP3A4ALOX15ABCB1ABCC9 | |
| SCHEMBL9216552 | 0.65 | CYP3A4 (0.58) | CYP3A4ALOX15ABCB1ABCC9 | |
| SCHEMBL13790822 | 0.65 | ALDH1A1 (0.49) | L3MBTL1ALDH1A1 | |
| SCHEMBL10591175 | 0.64 | CYP3A4 (0.80) | CYP3A4ALOX15ABCB1 | |
| SCHEMBL9398521 | 0.64 | CYP3A4 (0.80) | CYP3A4ALOX15ABCB1 |
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-5130322-A | CHROMAN DERIVATIVES | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1992-07-14 | — | — | US | disclosed |
| EP-0415065-A1 | Chroman derivatives | MERCK PATENT GmbH (DE) | 1991-03-06 | — | — | EP | disclosed |