Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5 | P09917 | 1/20 | 0.42 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 2/20 | 0.33 |
| ▸ | LTA4H | P09960 | 2/20 | 0.33 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.33 |
| ▸ | BAX | Q07812 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | HTT | P42858 | 2/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.32 |
| ▸ | NPC1 | O15118 | 2/20 | 0.32 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | ABL1 | P00519 | 1/20 | 0.32 |
| ▸ | PDE4A | P27815 | 1/20 | 0.32 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9512567 | 0.83 | KDM4E (0.43) | GAAHTTNPC1RAB9AKDM4E | |
| SCHEMBL9510450 | 0.77 | OPRK1 (0.41) | MAPTSMN1; SMN2NPC1TDP1RAB9A | |
| SCHEMBL9510505 | 0.72 | KDM4E (0.47) | GAAHTTSMN1; SMN2NPC1TP53 | |
| SCHEMBL9511863 | 0.63 | KMT2A (0.36) | HDAC8MAPTNPC1TDP1L3MBTL1 | |
| SCHEMBL9513581 | 0.62 | OPRK1 (0.36) | MAPTSMN1; SMN2NPC1RAB9AALDH1A1 | |
| SCHEMBL9636653 | 0.62 | NPC1 (0.41) | GAAMAPTSMN1; SMN2NPC1TDP1 | |
| SCHEMBL9508119 | 0.60 | LTA4H (0.52) | CA1CA2GAALTA4HNR1H2 | |
| SCHEMBL18609949 | 0.59 | IDO1 (0.59) | CA1CA2LTA4HNR1H2BAX | |
| SCHEMBL3888963 | 0.58 | LTA4H (0.71) | CA1CA2GAALTA4HNR1H2 | |
| SCHEMBL3895815 | 0.58 | LTA4H (0.71) | CA1CA2GAALTA4HNR1H2 |
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-0442115-B1 | Process for nucleus-chlorination of aromatic hydrocarbons | BAYER AG (DE) | 1993-11-24 | — | — | EP | disclosed |
| US-5105036-A | Friedel-Crafts catalyst and oxy-substituted cyclic amidines as cocatylsts; preferential formation of p-isomer | BAYER AKTIENGESELLSCHAFT (DE) | 1992-04-14 | — | — | US | disclosed |
| EP-0442115-A1 | Process for nucleus-chlorination of aromatic hydrocarbons | BAYER AG (DE) | 1991-08-21 | — | — | EP | disclosed |