Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH3A1 | P30838 | 1/20 | 0.46 |
| ▸ | VCAM1 | P19320 | 7/20 | 0.44 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.44 |
| ▸ | PGK1 | P00558 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL9427812 | 0.85 | ALDH3A1 (0.49) | ALDH3A1VCAM1HCAR3ALDH1A1MAPK1 | |
| SCHEMBL6084022 | 0.82 | VCAM1 (0.44) | VCAM1HCAR3PGK1ALDH1A1SLC6A4 | |
| SCHEMBL7572844 | 0.81 | ALDH1A1 (0.40) | VCAM1PGK1ALDH1A1SLC6A4MAPK1 | |
| SCHEMBL8773116 | 0.76 | ALDH3A1 (0.53) | ALDH3A1VCAM1HCAR3ALDH1A1MAPK1 | |
| SCHEMBL2477068 | 0.75 | TSHR (0.52) | VCAM1PGK1ALDH1A1MAPK1CYP3A4 | |
| SCHEMBL29653309 | 0.75 | TSHR (0.52) | VCAM1PGK1ALDH1A1MAPK1CYP3A4 | |
| SCHEMBL30110338 | 0.74 | TSHR (0.50) | VCAM1PGK1ALDH1A1SLC6A4MAPK1 | |
| SCHEMBL3543539 | 0.74 | TSHR (0.50) | VCAM1PGK1ALDH1A1SLC6A4MAPK1 | |
| SCHEMBL9301104 | 0.73 | ALDH1A1 (0.43) | ALDH3A1VCAM1HCAR3ALDH1A1SLC6A4 | |
| SCHEMBL9984967 | 0.71 | HTT (0.61) | ALDH3A1HCAR3ALDH1A1MAPK1MAPT |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0970040-B1 | METHOD FOR PRODUCING N-CARBOXYALKYL-3-FLUORO-4-DIALKYLAMINONILINES | CLARIANT GMBH (DE) | 2002-06-12 | — | — | EP | claimed |
| EP-0970040-B1 | METHOD FOR PRODUCING N-CARBOXYALKYL-3-FLUORO-4-DIALKYLAMINONILINES | CLARIANT GMBH (DE) | 2002-06-12 | — | — | EP | disclosed |
| EP-0970040-A1 | METHOD FOR PRODUCING N-CARBOXYALKYL-3-FLUORO-4-DIALKYLAMINONILINES | Clariant GmbH (DE) | 2000-01-12 | — | — | EP | disclosed |
| US-5990309-A | 2-chloro-5-fluoro-4-morpholinonitrobenzene and 2-chloro-5-fluoro-4-morpholinoaniline | CLARIANT GMBH (DE) | 1999-11-23 | — | — | US | disclosed |
| US-5917037-A | Process for the preparation of n-carboxyalkyl-3-fluoro-4-dialkylaminoanilines | CLARIANT GMBH (DE) | 1999-06-29 | — | — | US | disclosed |
| WO-1998040348-A1 | METHOD FOR PRODUCING N-CARBOXYALKYL-3-FLUORO-4-DIALKYLAMINONILINES | CLARIANT GMBH (DE) | 1998-09-17 | — | — | WO | disclosed |