Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DDB1 | Q16531 | 1/20 | 0.44 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.40 |
| ▸ | CXCR4 | P61073 | 15/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.37 |
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 SCHEMBL10574107 | 0.99 | DDB1 (0.43) | DDB1CRBNHDAC1HDAC6CXCR4 | |
| SCHEMBL9810162 | 0.88 | DDB1 (0.48) | DDB1CRBNHDAC1HDAC6CXCR4 | |
| Hydrochloric Acid SCHEMBL10568328 | 0.87 | DDB1 (0.47) | DDB1CRBNHDAC1HDAC6CXCR4 | |
| SCHEMBL9810195 | 0.85 | DDB1 (0.40) | DDB1CRBNCXCR4CYP2D6 | |
| SCHEMBL9810224 | 0.85 | DDB1 (0.39) | DDB1CRBNCXCR4CYP2D6 | |
| Hydrochloric Acid SCHEMBL10569209 | 0.84 | CXCR4 (0.40) | DDB1CRBNCXCR4CYP2D6 | |
| Hydrochloric Acid SCHEMBL10570078 | 0.84 | DDB1 (0.38) | DDB1CRBNCXCR4CYP2D6 | |
| SCHEMBL9770476 | 0.84 | HTR6 (0.40) | DDB1CRBNHDAC1HDAC6CXCR4 | |
| SCHEMBL9810216 | 0.83 | CYP2D6 (0.39) | DDB1CRBNCXCR4CYP2D6 | |
| SCHEMBL9810226 | 0.83 | DDB1 (0.40) | DDB1CRBNHDAC1HDAC6CXCR4 |
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-0254611-B1 | DERIVATIVES OF 8-PHENYLTHIOTETRAHYDROQUINOLINES AND THEIR SALTS, THEIR SYNTHESIS FOR USE AS MEDICAMENTS AND COMPOSITIONS CONTAINING THEM | ROUSSEL-UCLAF (FR) | 1991-06-12 | — | — | EP | disclosed |
| EP-0260724-A2 | Intermediates for the production of 2-substituted phenyl-4,5,6,7-tetrahydro-2H-isoindole-1,3-diones | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1988-03-23 | — | — | EP | disclosed |
| EP-0254611-A1 | Derivatives of 8-phenylthiotetrahydroquinolines and their salts, their synthesis for use as medicaments and compositions containing them | ROUSSEL-UCLAF (FR) | 1988-01-27 | — | — | EP | disclosed |