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 | |
|---|---|---|---|---|
| SCHEMBL8627491 | 0.78 | FAAH (0.35) | NOS2NOS1 | |
| SCHEMBL24829920 | 0.74 | NOS1 (0.45) | NOS2NOS1 | |
| SCHEMBL18224272 | 0.74 | NOS1 (0.45) | NOS2NOS1 | |
| SCHEMBL15656488 | 0.74 | — | — | |
| SCHEMBL27953389 | 0.73 | KMT2A (0.44) | NOS2NOS1 | |
| SCHEMBL27942666 | 0.73 | KMT2A (0.44) | NOS2NOS1 | |
| SCHEMBL24433004 | 0.73 | KMT2A (0.44) | NOS2NOS1 | |
| SCHEMBL9093089 | 0.72 | NOS2 (0.47) | NOS2 | |
| SCHEMBL8549021 | 0.72 | NOS2 (0.47) | NOS2 | |
| SCHEMBL28066720 | 0.72 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108863750-A | A kind of 2- butene-1, the synthetic method of 4- cyclohexadione compounds | 河南师范大学 | 2018-11-23 | — | — | CN | claimed |
| CN-108863750-A | A kind of 2- butene-1, the synthetic method of 4- cyclohexadione compounds | 河南师范大学 | 2018-11-23 | — | — | CN | disclosed |