Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR6 | P50406 | 4/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | HTR2C | P28335 | 2/20 | 0.44 |
| ▸ | HTR2B | P41595 | 1/20 | 0.44 |
| ▸ | PNMT | P11086 | 1/20 | 0.41 |
| ▸ | NOX1 | Q9Y5S8 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | LOX | P28300 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | HTR2A | P28223 | 1/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| (Phenylsulfonyl)Benzene SCHEMBL21753128 | 0.88 | HTR6 (0.70) | HTR6ALDH1A1POLBMAPTSMN1; SMN2 | |
| SCHEMBL9511311 | 0.87 | GAA (0.55) | ALDH1A1POLBMAPTSMN1; SMN2NOX1 | |
| SCHEMBL7360175 | 0.78 | TSHR (0.46) | ALDH1A1POLBMAPTSMN1; SMN2LMNA | |
| SCHEMBL7357401 | 0.78 | TDP1 (0.46) | ALDH1A1POLBMAPTHTR2CNOX1 | |
| (Phenylsulfonyl)Benzene SCHEMBL640901 | 0.76 | HTR6 (0.93) | HTR6ALDH1A1POLBMAPTSMN1; SMN2 | |
| SCHEMBL5051390 | 0.76 | HTR6 (0.93) | HTR6ALDH1A1POLBMAPTSMN1; SMN2 | |
| SCHEMBL28709181 | 0.74 | HTR6 (0.78) | HTR6ALDH1A1POLBMAPTSMN1; SMN2 | |
| SCHEMBL9140147 | 0.74 | HTR6 (0.78) | HTR6ALDH1A1POLBMAPTSMN1; SMN2 | |
| (Phenylsulfonyl)Benzene SCHEMBL28730795 | 0.73 | HTR6 (0.88) | HTR6ALDH1A1POLBMAPTSMN1; SMN2 | |
| (Phenylsulfonyl)Benzene SCHEMBL13735236 | 0.73 | HTR6 (1.00) | HTR6ALDH1A1POLBMAPTSMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0399293-B1 | PROCESS FOR PREPARING 2-CHLORO-4-NITRO-ALKYLBENZENE | BAYER AG (DE) | 1993-09-01 | — | — | EP | disclosed |
| US-5095157-A | Friedel-crafts catalyst | BAYER AKTIENGESELLSCHAFT (DE) | 1992-03-10 | — | — | US | disclosed |
| EP-0399293-A1 | Process for preparing 2-chloro-4-nitro-alkylbenzene | BAYER AG (DE) | 1990-11-28 | — | — | EP | disclosed |