Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 1/20 | 0.40 |
| ▸ | HTR2A | P28223 | 2/20 | 0.35 |
| ▸ | SPHK1 | Q9NYA1 | 7/20 | 0.34 |
| ▸ | RARB | P10826 | 2/20 | 0.34 |
| ▸ | RARA | P10276 | 1/20 | 0.34 |
| ▸ | RARG | P13631 | 1/20 | 0.34 |
| ▸ | HTR2C | P28335 | 1/20 | 0.34 |
| ▸ | SPHK2 | Q9NRA0 | 4/20 | 0.33 |
| ▸ | BCHE | P06276 | 1/20 | 0.33 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8450991 | 1.00 | S1PR1 (0.40) | S1PR1HTR2ASPHK1RARBRARA | |
| SCHEMBL8450937 | 0.99 | S1PR1 (0.39) | S1PR1HTR2ASPHK1RARBRARA | |
| SCHEMBL8452090 | 0.99 | S1PR1 (0.39) | S1PR1HTR2ASPHK1RARBRARA | |
| SCHEMBL8450941 | 0.99 | S1PR1 (0.39) | S1PR1HTR2ASPHK1RARBRARA | |
| SCHEMBL8452087 | 0.99 | S1PR1 (0.39) | S1PR1HTR2ASPHK1RARBRARA | |
| SCHEMBL8451558 | 0.96 | S1PR1 (0.36) | S1PR1HTR2AHTR2CBCHE | |
| SCHEMBL8451562 | 0.96 | S1PR1 (0.36) | S1PR1HTR2AHTR2CBCHE | |
| SCHEMBL8447323 | 0.94 | SPHK1 (0.46) | S1PR1SPHK1SPHK2 | |
| SCHEMBL8447324 | 0.94 | SPHK1 (0.46) | S1PR1SPHK1SPHK2 | |
| SCHEMBL8452466 | 0.93 | HTR2A (0.41) | HTR2ASPHK1RARBRARARARG |
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 |
|---|---|---|---|---|---|---|---|
| US-5858275-A | Chlorobenzene derivative and liquid crystal composition containing the same | CHISSO CORPORATION (JP) | 1999-01-12 | — | — | US | disclosed |
| EP-0785179-A1 | CHLOROBENZENE DERIVATIVE AND LIQUID-CRYSTAL COMPOSITION CONTAINING THE SAME | CHISSO CORPORATION (JP) | 1997-07-23 | — | — | EP | disclosed |