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 | |
|---|---|---|---|---|
| SCHEMBL22686379 | 0.92 | ALDH1A1 (0.42) | CHRNB2CHRNA4 | |
| SCHEMBL22686378 | 0.92 | ALDH1A1 (0.42) | CHRNB2CHRNA4 | |
| SCHEMBL21647191 | 0.77 | CHRNB2 (0.47) | CHRNB2CHRNA4 | |
| SCHEMBL6366698 | 0.74 | CHRNB2 (0.43) | CHRNB2CHRNA4 | |
| SCHEMBL28961390 | 0.67 | CHRNB2 (0.55) | CHRNB2CHRNA4 | |
| SCHEMBL11233101 | 0.66 | CHRNB2 (0.43) | CHRNB2CHRNA4 | |
| SCHEMBL4299439 | 0.66 | NTRK1 (0.47) | — | |
| (+/-)Nicotine SCHEMBL27498265 | 0.66 | ALDH1A1 (0.83) | CHRNB2CHRNA4 | |
| SCHEMBL3058805 | 0.65 | CHRNB2 (0.62) | CHRNB2CHRNA4 | |
| SCHEMBL3058809 | 0.65 | CHRNB2 (0.62) | CHRNB2CHRNA4 |
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-111620865-A | Heterocyclic compound, application thereof and pharmaceutical composition containing same | 苏州信诺维医药科技有限公司 | 2020-09-04 | — | — | CN | disclosed |
| CN-110156772-B | Heterocyclic compound, application thereof and pharmaceutical composition containing same | 苏州信诺维医药科技有限公司 | 2020-08-07 | — | — | CN | disclosed |