Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | CCR6 | P51684 | 1/20 | 0.43 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.43 |
| ▸ | CETP | P11597 | 3/20 | 0.41 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | CCKBR | P32239 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL11571244 | 0.83 | CTRC (0.45) | ALDH1A1L3MBTL1CYP3A4TSHRMAPK1 | |
| SCHEMBL27916412 | 0.81 | EPOR (0.47) | SIRT2 | |
| SCHEMBL28110794 | 0.81 | ALDH1A1 (0.46) | ALDH1A1L3MBTL1CYP3A4TSHRMAPK1 | |
| SCHEMBL20166038 | 0.81 | ALDH1A1 (0.49) | ALDH1A1L3MBTL1CYP3A4TSHRMAPK1 | |
| SCHEMBL27644241 | 0.81 | FOLH1 (0.50) | ALDH1A1L3MBTL1CYP3A4TSHRMAPK1 | |
| SCHEMBL27644244 | 0.81 | FOLH1 (0.50) | ALDH1A1L3MBTL1CYP3A4TSHRMAPK1 | |
| Methyl 3-Phenylpropanoate SCHEMBL28101689 | 0.81 | ABCB1 (0.44) | ALDH1A1TDP1CCR6PAX8SIRT2 | |
| SCHEMBL27870520 | 0.80 | ITGB3 (0.43) | ALDH1A1L3MBTL1CYP3A4TSHRMAPK1 | |
| SCHEMBL30744367 | 0.80 | CETP (0.46) | ALDH1A1L3MBTL1CYP3A4TSHRMAPK1 | |
| SCHEMBL20794168 | 0.79 | ALDH1A1 (0.49) | ALDH1A1L3MBTL1CYP3A4TSHRMAPK1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5347007-A | Mesylated hydroxymethyl compound treated with alkali metal chloride or quaternary ammonium chloride to form chloromethylamide compound | E. R. SQUIBB & SONS, INC. (US) | 1994-09-13 | — | — | US | disclosed |
| US-5281716-A | Enzyme inhibitors for anticoagulants | BRISTOL-MYERS SQUIBB COMPANY (US) | 1994-01-25 | — | — | US | disclosed |
| EP-0575069-A1 | Method for preparing 7-oxabicycloheptyl substituted oxazole amide prostaglandin analog intermediates useful in the preparation of antithrombotic and anti-vasospastic compounds | E.R. Squibb & Sons, Inc. (US) | 1993-12-22 | — | — | EP | disclosed |
| US-5260448-A | Treating a vinyl bromide containing compound with a metal carbonate cyclizing agent | E. R. SQUIBB & SONS, INC. (US) | 1993-11-09 | — | — | US | disclosed |
| US-5260449-A | Method for preparing 7-oxabicycloheptyl substituted bromooxazole amide prostaglandin analog intermediates useful in the preparation of anti-thrombotic and anti-vasospastic compounds | E. R. SQUIBB & SONS, INC. (US) | 1993-11-09 | — | — | US | disclosed |