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 | |
|---|---|---|---|---|
| SCHEMBL30775724 | 1.00 | TOP2A (0.32) | TOP2AABCB1 | |
| SCHEMBL29164457 | 0.75 | LTB4R (0.33) | — | |
| SCHEMBL29164512 | 0.75 | CYP2C19 (0.32) | — | |
| SCHEMBL29180164 | 0.68 | CYP2C9 (0.33) | — | |
| SCHEMBL27914390 | 0.66 | KCNE1 (0.33) | ABCB1 | |
| SCHEMBL30775718 | 0.66 | TOP2A (0.32) | TOP2A | |
| SCHEMBL29722973 | 0.66 | HSP90AA1 (0.40) | ABCB1 | |
| SCHEMBL2045223 | 0.66 | HSP90AA1 (0.40) | ABCB1 | |
| SCHEMBL31208307 | 0.64 | DUT (0.35) | — | |
| SCHEMBL31208316 | 0.64 | DUT (0.33) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-117658967-A | Preparation method of flavan-3, 4-diol derivative | 朗华生物科学(深圳)有限公司 | 2024-03-08 | — | — | CN | disclosed |