Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | KDM2B | Q8NHM5 | 2/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | CHRM2 | P08172 | 3/20 | 0.39 |
| ▸ | CHRM4 | P08173 | 3/20 | 0.39 |
| ▸ | CHRM5 | P08912 | 3/20 | 0.39 |
| ▸ | CHRM1 | P11229 | 3/20 | 0.39 |
| ▸ | CHRM3 | P20309 | 3/20 | 0.39 |
| ▸ | DRD2 | P14416 | 1/20 | 0.39 |
| ▸ | DRD1 | P21728 | 1/20 | 0.39 |
| ▸ | ARG1 | P05089 | 3/20 | 0.37 |
| ▸ | ARG2 | P78540 | 3/20 | 0.37 |
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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL2267524 | 0.98 | SMN1; SMN2 (0.46) | ALDH1A1KDM4ESMN1; SMN2CYP1A2MAPK1 | |
| Trifluoroacetic Acid SCHEMBL16701135 | 0.89 | CYP1A2 (0.48) | ALDH1A1KDM4ESMN1; SMN2CYP1A2MAPK1 | |
| Trifluoroacetic Acid SCHEMBL5616394 | 0.87 | CYP1A2 (0.47) | ALDH1A1KDM4ESMN1; SMN2CYP1A2MAPK1 | |
| Trifluoroacetic Acid SCHEMBL16700590 | 0.85 | KDM4E (0.48) | ALDH1A1KDM4ESMN1; SMN2CYP1A2MAPK1 | |
| SCHEMBL5017222 | 0.85 | SMN1; SMN2 (0.47) | ALDH1A1KDM4ESMN1; SMN2CYP1A2MAPK1 | |
| SCHEMBL5017224 | 0.85 | SMN1; SMN2 (0.47) | ALDH1A1KDM4ESMN1; SMN2CYP1A2MAPK1 | |
| Trifluoroacetic Acid SCHEMBL28941864 | 0.84 | HRH3 (0.50) | ALDH1A1KDM4ESMN1; SMN2CYP1A2MAPK1 | |
| Acetic Acid SCHEMBL15820185 | 0.83 | SMN1; SMN2 (0.48) | ALDH1A1KDM4ESMN1; SMN2CYP1A2MAPK1 | |
| Trifluoroacetic Acid SCHEMBL2265537 | 0.82 | HSD11B1 (0.42) | ALDH1A1KDM4ESMN1; SMN2CYP1A2MAPK1 | |
| Trifluoromethanesulfonic Acid SCHEMBL29252564 | 0.80 | DRD2 (0.43) | ALDH1A1KDM4ESMN1; SMN2MAPK1POLB |
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 |
|---|---|---|---|---|---|---|---|
| US-8188084-B2 | Pyridinone and pyridazinone derivatives as inhibitors of poly (ADP-ribose) polymerase (PARP) | ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI SPA. (IT) | 2012-05-29 | — | — | US | disclosed |
| US-20090176765-A1 | Pyridinone and Pyridazinone Derivatives as Inhibitors of Poly (Adp-Ribose) Polymerase (Parp) | MSD ITALIA S.R.L. (IT) | 2009-07-09 | — | — | 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-20090176765-A1 | Pyridinone and Pyridazinone Derivatives as Inhibitors of Poly (Adp-Ribose) Polymerase (Parp) | PARP1, PARP2, PARP3 | ALDH1A1 278/4885KDM4E 3069/4885SMN1; SMN2 1804/4885 |
“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.