Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.36 |
| ▸ | CFD | P00746 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 3/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | IDO1 | P14902 | 1/20 | 0.34 |
| ▸ | KAT2B | Q92831 | 1/20 | 0.34 |
| ▸ | KMO | O15229 | 2/20 | 0.33 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.33 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.33 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.33 |
| ▸ | KAT6A | Q92794 | 1/20 | 0.33 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.32 |
| ▸ | PTGIR | P43119 | 1/20 | 0.32 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL20844391 | 0.79 | GAA (0.43) | CYP1A2CYP2A6CFDGAATSHR | |
| SCHEMBL27958350 | 0.78 | USP2 (0.32) | — | |
| SCHEMBL7654371 | 0.77 | TSHR (0.47) | CYP1A2CYP2A6TSHRLMNAIDO1 | |
| SCHEMBL320817 | 0.76 | — | — | |
| SCHEMBL5795609 | 0.76 | CFD (0.37) | CFDGAAKMONOTUMPTGIR | |
| SCHEMBL2455081 | 0.75 | CES2 (0.39) | PTGIR | |
| SCHEMBL2698637 | 0.74 | KMO (0.33) | CYP1A2CYP2A6CFDGAAIDO1 | |
| SCHEMBL31314552 | 0.71 | CYP3A4 (0.42) | TSHRNR4A2ALDH1A1TDP1 | |
| SCHEMBL6829483 | 0.71 | GAA (0.35) | CYP1A2GAATAAR1 | |
| SCHEMBL29116329 | 0.71 | CYP3A4 (0.42) | TSHRNR4A2ALDH1A1TDP1 |
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-0682008-B1 | Substituted 2-chloro-3,4,5-trifluorobenzenes and process for their preparation | CLARIANT GMBH (DE) | 1998-12-30 | — | — | EP | disclosed |
| US-5565612-A | Substituted 2-chloro-3,4,5-trifluorobenzenes and a process for their preparation | HOECHST AKTIENGESELLSCHAFT (DE) | 1996-10-15 | — | — | US | disclosed |
| EP-0682008-A1 | Substituted 2-chloro-3,4,5-trifluorobenzenes and process for their preparation | HOECHST AKTIENGESELLSCHAFT (DE) | 1995-11-15 | — | — | EP | disclosed |