Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | PTPRC | P08575 | 3/20 | 0.34 |
| ▸ | S100A4 | P26447 | 2/20 | 0.34 |
| ▸ | BCHE | P06276 | 1/20 | 0.34 |
| ▸ | ACHE | P22303 | 1/20 | 0.34 |
| ▸ | CES1 | P23141 | 1/20 | 0.34 |
| ▸ | CASP3 | P42574 | 2/20 | 0.34 |
| ▸ | CASP1 | P29466 | 1/20 | 0.34 |
| ▸ | CASP4 | P49662 | 1/20 | 0.34 |
| ▸ | CASP7 | P55210 | 1/20 | 0.34 |
| ▸ | CASP9 | P55211 | 1/20 | 0.34 |
| ▸ | CASP6 | P55212 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | MALT1 | Q9UDY8 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CA7 | P43166 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8088432 | 0.80 | PDE4A (0.43) | CASP3MALT1 | |
| SCHEMBL7268307 | 0.80 | ALDH1A1 (0.39) | ALDH1A1TDP1CYP3A4PTPRCS100A4 | |
| SCHEMBL8084547 | 0.79 | ALDH1A1 (0.36) | ALDH1A1TDP1CYP3A4PTPRCS100A4 | |
| SCHEMBL8077241 | 0.78 | ALDH1A1 (0.36) | ALDH1A1TDP1CYP3A4PTPRCS100A4 | |
| SCHEMBL8085305 | 0.77 | ALDH1A1 (0.36) | ALDH1A1TDP1CYP3A4PTPRCS100A4 | |
| SCHEMBL8085035 | 0.77 | ALDH1A1 (0.38) | ALDH1A1TDP1CYP3A4PTPRCS100A4 | |
| SCHEMBL7298971 | 0.76 | CCNC (0.33) | ALDH1A1MEN1KMT2AMAPK14 | |
| SCHEMBL8085331 | 0.76 | HSD17B10 (0.38) | ALDH1A1TDP1CYP3A4PTPRCS100A4 | |
| SCHEMBL10694147 | 0.75 | ALDH1A1 (0.36) | ALDH1A1TDP1CYP3A4PTPRCS100A4 | |
| SCHEMBL8084998 | 0.75 | ALDH1A1 (0.34) | ALDH1A1TDP1CYP3A4PTPRCS100A4 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6153627-A | Chroman derivatives | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 2000-11-28 | — | — | US | disclosed |
| US-6040308-A | Chroman derivatives | MERCK GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 2000-03-21 | — | — | US | disclosed |
| US-5387587-A | Chroman derivatives | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1995-02-07 | — | — | US | disclosed |