Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1B1 | P15121 | 2/20 | 0.52 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | FFAR3 | O14843 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | CES2 | O00748 | 2/20 | 0.46 |
| ▸ | CES1 | P23141 | 2/20 | 0.46 |
| ▸ | CXCL8 | P10145 | 2/20 | 0.44 |
| ▸ | ERCC5 | P28715 | 1/20 | 0.44 |
| ▸ | FEN1 | P39748 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| 1,2-Dichlorobenzene SCHEMBL27488250 | 0.98 | AKR1B1 (0.50) | AKR1B1LMNATSHRFFAR3ALDH1A1 | |
| Chlorobenzene SCHEMBL27460518 | 0.85 | TSHR (0.55) | AKR1B1TSHRFFAR3KMT2ACES2 | |
| Chlorobenzene SCHEMBL6906848 | 0.85 | TSHR (0.55) | AKR1B1TSHRFFAR3KMT2ACES2 | |
| 1,2-Dichlorobenzene SCHEMBL27361510 | 0.85 | LMNA (0.50) | AKR1B1LMNATSHRALDH1A1TP53 | |
| 1,2-Dichlorobenzene SCHEMBL27864018 | 0.85 | ALDH1A1 (0.50) | AKR1B1LMNATSHRALDH1A1TP53 | |
| 2,6-Dichlorophenol SCHEMBL2898216 | 0.84 | AKR1B1 (0.52) | AKR1B1TSHRFFAR3ALDH1A1TP53 | |
| Propionic Acid SCHEMBL28241286 | 0.84 | TSHR (0.52) | AKR1B1LMNATSHRFFAR3ALDH1A1 | |
| 1,2-Dichlorobenzene SCHEMBL27549946 | 0.83 | LMNA (0.48) | AKR1B1LMNATSHRALDH1A1TP53 | |
| 1,2-Dichlorobenzene SCHEMBL27647229 | 0.83 | LMNA (0.48) | LMNATSHRALDH1A1TP53KMT2A | |
| Chlorobenzene SCHEMBL28177257 | 0.83 | TSHR (0.52) | AKR1B1TSHRFFAR3ALDH1A1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| CN-107759460-A | A kind of method for preparing the more acid monomers of polyphenyls | 朱翠英 | 2018-03-06 | — | — | CN | disclosed |
| US-5130329-A | Amino, amide substituted compounds | ROUSSEL UCLAF (FR) | 1992-07-14 | — | — | US | disclosed |
| US-5068244-A | Benzcarbocyclic amides with nitro groups | ROUSSEL UCLAF (FR) | 1991-11-26 | — | — | US | disclosed |