Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.42 |
| ▸ | NOD2 | Q9HC29 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | PLK1 | P53350 | 1/20 | 0.38 |
| ▸ | MAOB | P27338 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 2/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 3/20 | 0.37 |
| ▸ | ESR1 | P03372 | 2/20 | 0.37 |
| ▸ | AHR | P35869 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | CA12 | O43570 | 3/20 | 0.36 |
| ▸ | CA1 | P00915 | 3/20 | 0.36 |
| ▸ | CA2 | P00918 | 3/20 | 0.36 |
| ▸ | CA7 | P43166 | 3/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL3226975 | 0.78 | L3MBTL1 (0.49) | KDM4EL3MBTL1PLK1MAOBPOLB | |
| SCHEMBL3977434 | 0.70 | KMT2A (0.47) | KDM4EL3MBTL1PLK1NPSR1MAPT | |
| SCHEMBL29266100 | 0.69 | NR1H2 (0.59) | KDM4EL3MBTL1ESR1CA12CA1 | |
| SCHEMBL30214364 | 0.69 | TSHR (0.50) | KDM4EL3MBTL1POLBNPSR1GPR55 | |
| SCHEMBL623140 | 0.68 | MAOB (0.49) | KDM4EL3MBTL1MAOBPOLBNPSR1 | |
| SCHEMBL7929808 | 0.68 | CA12 (0.50) | MAPTESR1NPC1RAB9ATSHR | |
| SCHEMBL7929807 | 0.68 | CA12 (0.50) | ESR1NPC1RAB9ACA12CA1 | |
| SCHEMBL21982601 | 0.67 | CA12 (0.53) | KDM4EMAPTESR1NPC1RAB9A | |
| SCHEMBL9840246 | 0.67 | KDM4E (0.46) | KDM4ENOD2L3MBTL1MAOBPOLB | |
| SCHEMBL15721490 | 0.67 | ESR1 (0.51) | KDM4ENOD2MAPTESR1NPC1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-1918138-B | Thiadiazole compounds as CXC-and CC-chemokine receptor ligands | SCHERING CORP | 2011-05-04 | — | — | CN | disclosed |
| CN-1720240-B | Thiadiazoledioxides and thiadiazoleoxides as CXC- and CC-chemokine receptor ligands | SCHERING CORP | 2010-10-27 | — | — | CN | disclosed |
| CN-1918156-B | Isothiazole dioxides as CXC-and CC-chemokine receptor ligands | SCHERING CORP | 2010-10-27 | — | — | CN | disclosed |
| CN-1918156-A | Isothiazole dioxides as CXC-and CC-chemokine receptor ligands | SCHERING CORP AND PHARMACOPEIA (US) | 2007-02-21 | — | — | CN | disclosed |
| CN-1918138-A | Thiadiazole compounds as CXC-and CC-chemokine receptor ligands | SCHERING CORP AND PHARMACOPEIA (US) | 2007-02-21 | — | — | CN | disclosed |
| CN-1720240-A | Thiadiazoledioxides and thiadiazoleoxides as CXC- and CC-chemokine receptor ligands | SCHERING CORP (US) | 2006-01-11 | — | — | CN | disclosed |