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 | |
|---|---|---|---|---|
| SCHEMBL20628690 | 0.90 | — | — | |
| SCHEMBL24932484 | 0.87 | — | — | |
| SCHEMBL13232338 | 0.86 | ALDH1A1 (0.38) | ALDH1A1TDP1 | |
| SCHEMBL3111535 | 0.82 | — | — | |
| SCHEMBL1760664 | 0.82 | — | — | |
| SCHEMBL3106063 | 0.82 | ALDH1A1 (0.43) | ALDH1A1TDP1 | |
| Hydrochloric Acid SCHEMBL30536202 | 0.78 | ALDH1A1 (0.41) | ALDH1A1TDP1 | |
| Hydrochloric Acid SCHEMBL29482099 | 0.78 | ALDH1A1 (0.41) | ALDH1A1TDP1 | |
| SCHEMBL71836 | 0.78 | — | — | |
| SCHEMBL12672110 | 0.75 | ALDH1A1 (0.32) | ALDH1A1TDP1 |
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-2018095426-A1 | PYRAZOLO-HETEROARYL DERIVATIVE, PREPARATION METHOD AND MEDICAL USE THEREOF | 江苏恒瑞医药股份有限公司 | 2018-05-31 | — | — | WO | disclosed |