Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | CHRM3 | P20309 | 3/20 | 0.35 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.31 |
| ▸ | SHBG | P04278 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL27755270 | 0.77 | KDM4E (0.39) | KDM4ETP53CHRM3SIGMAR1ALDH1A1 | |
| SCHEMBL14547195 | 0.70 | MC4R (0.46) | KDM4ETP53CHRM3SIGMAR1LMNA | |
| SCHEMBL26089086 | 0.69 | — | — | |
| SCHEMBL11608930 | 0.69 | MC4R (0.34) | CHRM3SIGMAR1 | |
| SCHEMBL20938908 | 0.69 | KDM4E (0.46) | KDM4ETP53CHRM3SIGMAR1ALDH1A1 | |
| SCHEMBL8652418 | 0.66 | SHBG (0.39) | TP53EPHX1SHBG | |
| SCHEMBL11449188 | 0.66 | SHBG (0.39) | TP53EPHX1SHBG | |
| SCHEMBL4865536 | 0.66 | SHBG (0.39) | TP53EPHX1SHBG | |
| SCHEMBL4865547 | 0.66 | SHBG (0.39) | TP53EPHX1SHBG | |
| SCHEMBL19293305 | 0.66 | KDM4E (0.48) | KDM4ETP53CHRM3SIGMAR1ALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1694653-A1 | SUBSTITUTED 6-CYCLOHEXYLALKYL SUBSTITUTED 2-QUINOLINONES AND 2-QUINOXALINONES AS POLY(ADP-RIBOSE) POLYMERASE INHIBITORS | JANSSEN PHARMACEUTICA N.V. (BE) | 2006-08-30 | — | — | EP | disclosed |
| WO-2005058843-A1 | SUBSTITUTED 6-CYCLOHEXYLALKYL SUBSTITUTED 2-QUINOLINONES AND 2-QUINOXALINONES AS POLY(ADP-RIBOSE) POLYMERASE INHIBITORS | JANSSEN PHARMACEUTICA N.V. (BE) | 2005-06-30 | — | — | WO | disclosed |