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 | |
|---|---|---|---|---|
| SCHEMBL4806982 | 0.74 | PGD (0.43) | ALDH1A1TDP1 | |
| SCHEMBL4807998 | 0.74 | PGD (0.43) | ALDH1A1TDP1 | |
| SCHEMBL34475233 | 0.72 | — | — | |
| Acetone SCHEMBL1147312 | 0.71 | ALDH1A1 (0.34) | ALDH1A1TDP1 | |
| Acetic Acid SCHEMBL2728218 | 0.69 | FFAR3 (0.37) | ALDH1A1TDP1 | |
| Propane SCHEMBL4876307 | 0.69 | — | — | |
| SCHEMBL9027 | 0.69 | — | — | |
| SCHEMBL10679392 | 0.69 | TSHR (0.39) | ALDH1A1TDP1 | |
| SCHEMBL9026 | 0.69 | — | — | |
| SCHEMBL3475223 | 0.69 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2005054429-A2 | SYNTHESIS OF THE C1-C6 KETO-ACID SYNTHON OF THE EPOTHILONES | THE UNIVERSITY OF MISSISSIPPI (US) | 2005-06-16 | — | — | WO | disclosed |