Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC4 | P56524 | 2/20 | 0.48 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.48 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | HPGD | P15428 | 3/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.42 |
| ▸ | CA12 | O43570 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 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 | |
|---|---|---|---|---|
| SCHEMBL30527909 | 0.81 | L3MBTL1 (0.51) | KDM4ETSHRALDH1A1MAPTHPGD | |
| SCHEMBL2167797 | 0.76 | BACE1 (0.52) | KDM4EALDH1A1MAPTTDP1CYP19A1 | |
| SCHEMBL7351176 | 0.75 | CYP19A1 (0.55) | KDM4ESMN1; SMN2TSHRHTTALDH1A1 | |
| SCHEMBL9850097 | 0.75 | NCOA1 (0.48) | HDAC4HDAC8KDM4ESMN1; SMN2ALDH1A1 | |
| SCHEMBL196223 | 0.72 | CA12 (0.68) | HDAC4HDAC2HDAC8KDM4ESMN1; SMN2 | |
| SCHEMBL7349003 | 0.70 | CYP19A1 (0.48) | KDM4EALDH1A1MAPTHPGDCYP19A1 | |
| SCHEMBL10841088 | 0.70 | HDAC4 (0.54) | HDAC4HDAC2HDAC8KDM4ESMN1; SMN2 | |
| SCHEMBL16812904 | 0.68 | HDAC4 (0.74) | HDAC4HDAC2HDAC8KDM4ESMN1; SMN2 | |
| SCHEMBL5197914 | 0.68 | CA12 (0.56) | HDAC4HDAC2HDAC8KDM4ESMN1; SMN2 | |
| SCHEMBL16109474 | 0.68 | HDAC4 (0.65) | HDAC4HDAC2HDAC8KDM4ESMN1; SMN2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1998027077-A1 | 2,1,3-BENZOTHIA(OXA)DIAZOLE DERIVATIVES AND THEIR USE AS ENDOTHELIN-RECEPTOR ANTAGONISTS | MERCK PATENT GMBH (DE) | 1998-06-25 | — | — | WO | disclosed |