Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 20/20 | 0.46 |
| ▸ | HTR2B | P41595 | 20/20 | 0.46 |
| ▸ | HTR2A | P28223 | 14/20 | 0.44 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL22720315 | 0.98 | HTR2C (0.45) | HTR2CHTR2BHTR2A | |
| SCHEMBL22724651 | 0.82 | HTR2C (0.49) | HTR2CHTR2BHTR2A | |
| SCHEMBL22724570 | 0.78 | HTR2C (0.35) | HTR2CHTR2BHTR2A | |
| SCHEMBL337382 | 0.78 | HTR2C (0.51) | HTR2CHTR2BHTR2A | |
| SCHEMBL337619 | 0.78 | HTR2C (0.51) | HTR2CHTR2BHTR2A | |
| SCHEMBL337591 | 0.78 | HTR2C (0.51) | HTR2CHTR2BHTR2A | |
| Hydrochloric Acid SCHEMBL23124413 | 0.77 | HTR2C (0.50) | HTR2CHTR2BHTR2A | |
| Hydrochloric Acid SCHEMBL9940935 | 0.77 | HTR2C (0.50) | HTR2CHTR2BHTR2A | |
| Hydrochloric Acid SCHEMBL14816152 | 0.77 | HTR2C (0.50) | HTR2CHTR2BHTR2A | |
| Trifluoroacetic Acid SCHEMBL31257489 | 0.75 | PARP1 (0.39) | HTR2CHTR2BHTR2A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113396147-B | Aromatic heterocyclic derivative regulator, preparation method and application thereof | 上海翰森生物医药科技有限公司 | 2024-06-18 | — | — | CN | disclosed |
| CN-113396147-A | Aromatic heterocyclic derivative regulator, preparation method and application thereof | 上海翰森生物医药科技有限公司 | 2021-09-14 | — | — | CN | disclosed |
| WO-2020239123-A1 | AROMATIC HETEROCYCLIC DERIVATIVE MODULATOR AND PREPARATION METHOD THEREFOR AND USE THEREOF | 上海翰森生物医药科技有限公司 | 2020-12-03 | — | — | WO | disclosed |