Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | CHRNB2 | P17787 | 3/20 | 0.36 |
| ▸ | CHRNA4 | P43681 | 3/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.36 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.36 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.36 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | GBA1 | P04062 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL929655 | 0.83 | USP30 (0.39) | ALDH1A1MAPK1CYP1A2CYP2D6CYP3A4 | |
| SCHEMBL929129 | 0.83 | FAAH (0.38) | ALDH1A1MAPK1CYP1A2NR1H2NR1H3 | |
| SCHEMBL928239 | 0.82 | CYP2D6 (0.35) | ALDH1A1CHRNB2CHRNA4CYP1A2CYP2D6 | |
| SCHEMBL928152 | 0.79 | MEN1 (0.41) | ALDH1A1MAPK1MEN1KMT2AKDM4E | |
| SCHEMBL928386 | 0.79 | NPC1 (0.35) | ALDH1A1CYP1A2CYP2D6CYP3A4CYP2C19 | |
| SCHEMBL928612 | 0.79 | CYP2D6 (0.35) | CHRNA4CYP1A2CYP2D6CYP3A4CYP2C19 | |
| SCHEMBL6332378 | 0.77 | ALDH1A1 (0.41) | ALDH1A1MAPK1CHRNB2CHRNA4CYP1A2 | |
| SCHEMBL1794096 | 0.76 | CYP2D6 (0.35) | ALDH1A1CYP1A2CYP2D6CYP3A4CYP2C19 | |
| SCHEMBL6322920 | 0.74 | CHRNB2 (0.50) | ALDH1A1MAPK1CHRNB2CHRNA4CYP1A2 | |
| SCHEMBL1792844 | 0.71 | CHRNB2 (0.43) | ALDH1A1CHRNB2CHRNA4CYP1A2CHRNA7 |
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 |
|---|---|---|---|---|---|---|---|
| US-20050065178-A1 | Substituted diazabicycloakane derivatives | ABBOTT LABORATORIES | 2005-03-24 | — | — | US | disclosed |
Patent text — is the patent's own abstract consistent with the prediction?
For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.
| Patent | Title | Text reads most about | Predicted target · text-rank |
|---|---|---|---|
| US-20050065178-A1 | Substituted diazabicycloakane derivatives | CHRNA7, CHRNA1, CHRNA5 | ALDH1A1 537/4885MAPK1 1830/4885CHRNB2 12/4885 |
“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.