Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR35 | Q9HC97 | 6/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.47 |
| ▸ | TSHR | P16473 | 3/20 | 0.47 |
| ▸ | SNCA | P37840 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.43 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | TTR | P02766 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.41 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL304939 | 0.88 | GPR35 (0.48) | GPR35ALDH1A1TDP1TSHRSNCA | |
| SCHEMBL21143325 | 0.86 | GPR35 (0.52) | GPR35ALDH1A1TDP1TSHRSNCA | |
| SCHEMBL28728496 | 0.86 | GPR35 (0.57) | GPR35ALDH1A1TDP1SNCACYP1A2 | |
| SCHEMBL29457573 | 0.86 | GPR35 (0.57) | GPR35ALDH1A1TDP1SNCACYP1A2 | |
| SCHEMBL2519558 | 0.85 | TSHR (0.55) | GPR35ALDH1A1TDP1TSHRCYP1A2 | |
| SCHEMBL18874784 | 0.82 | GPR35 (0.55) | GPR35ALDH1A1TDP1SNCACYP1A2 | |
| SCHEMBL1826938 | 0.80 | GPR35 (0.48) | GPR35ALDH1A1TDP1TSHRSNCA | |
| SCHEMBL2224314 | 0.80 | GPR35 (0.59) | GPR35ALDH1A1TDP1TSHRCYP1A2 | |
| SCHEMBL30785537 | 0.80 | GPR35 (0.59) | GPR35ALDH1A1TDP1TSHRCYP1A2 | |
| SCHEMBL2581016 | 0.79 | CYP1A2 (0.62) | GPR35ALDH1A1TDP1TSHRCYP1A2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0630883-B1 | Novel process to prepare N-alkyl-3,4-dialkyl-2,6-dinitroanilines | AGAN CHEMICAL MANUFACTURERS (IL) | 1998-09-16 | — | — | EP | disclosed |
| US-5602283-A | Multi-stage process for preparing N-alkyl-3,4-dialkyl-2,6-dinitroanilines | AGAN CHEMICAL MANUFACTURERS LTD. (IL) | 1997-02-11 | — | — | US | disclosed |
| US-5475148-A | Process and intermediate to prepare N-alkyl-3,4-dialkyl-2,6-dinitro-anilines | AGAN CHEMICAL MANUFACTURERS LTD. (IL) | 1995-12-12 | — | — | US | disclosed |
| EP-0630883-A1 | Novel process to prepare N-alkyl-3,4-dialkyl-2,6-dinitroanilines | AGAN CHEMICAL MANUFACTURERS LTD. (IL) | 1994-12-28 | — | — | EP | disclosed |