Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTPS1 | P17812 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.30 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
| ▸ | GLA | P06280 | 1/20 | 0.30 |
| ▸ | TRPV4 | Q9HBA0 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL16467792 | 0.79 | L3MBTL1 (0.44) | CTPS1TSHRPOLBGLATRPV4 | |
| SCHEMBL9511270 | 0.78 | L3MBTL1 (0.35) | ALDH1A1 | |
| SCHEMBL9510093 | 0.75 | TRPV4 (0.41) | TRPV4 | |
| SCHEMBL9507595 | 0.75 | TRPV4 (0.41) | TRPV4 | |
| SCHEMBL16467798 | 0.73 | SMN1; SMN2 (0.40) | POLB | |
| SCHEMBL13290923 | 0.71 | TRPV4 (0.50) | TSHRPOLBTRPV4ALDH1A1 | |
| SCHEMBL5318058 | 0.71 | ALDH1A1 (0.49) | TSHRPOLBTRPV4ALDH1A1 | |
| SCHEMBL9950188 | 0.69 | TRPV4 (0.38) | TSHRPOLBTRPV4ALDH1A1 | |
| SCHEMBL9507618 | 0.68 | GAA (0.48) | POLBALDH1A1 | |
| SCHEMBL15353058 | 0.68 | KDM4E (0.42) | TSHR |
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 |