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 | |
|---|---|---|---|---|
| SCHEMBL9565797 | 0.79 | CHRM2 (0.39) | CYP2A6 | |
| SCHEMBL9565769 | 0.74 | CYP2A6 (0.44) | CYP2A6 | |
| SCHEMBL25060063 | 0.68 | PTGDR2 (0.35) | — | |
| SCHEMBL507807 | 0.67 | LSS (0.39) | CYP2A6LSS | |
| SCHEMBL19265610 | 0.67 | HTR2C (0.38) | CYP2A6 | |
| SCHEMBL25232594 | 0.66 | CYP2A6 (0.46) | CYP2A6 | |
| SCHEMBL30445252 | 0.66 | CYP2A6 (0.46) | CYP2A6 | |
| SCHEMBL25790635 | 0.66 | — | — | |
| SCHEMBL2744417 | 0.65 | — | — | |
| SCHEMBL5017155 | 0.65 | LSS (0.40) | CYP2A6LSS |
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 |
|---|---|---|---|---|---|---|---|
| EP-0526951-A1 | 3-Phenyl benzo b thiophenes as pesticidal compounds | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1993-02-10 | — | — | EP | disclosed |