Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CISD1 | Q9NZ45 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.35 |
| ▸ | NPC1 | O15118 | 2/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 3/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.33 |
| ▸ | P2RY12 | Q9H244 | 4/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | IGF1R | P08069 | 1/20 | 0.32 |
| ▸ | MITF | O75030 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | ATF1 | P18846 | 1/20 | 0.32 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.32 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.32 |
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 SCHEMBL2995753 | 1.00 | CISD1 (0.35) | CISD1ALDH1A1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL4587399 | 0.95 | ALDH1A1 (0.38) | CISD1ALDH1A1NPC1RAB9ASMN1; SMN2 | |
| Trifluoroacetic Acid SCHEMBL2991044 | 0.89 | DHODH (0.38) | CISD1NPC1RAB9AMEN1KMT2A | |
| Trifluoroacetic Acid SCHEMBL5049812 | 0.89 | DHODH (0.38) | CISD1NPC1RAB9AMEN1KMT2A | |
| SCHEMBL4586480 | 0.87 | IGF1R (0.37) | CISD1ALDH1A1NPC1RAB9ASMN1; SMN2 | |
| Trifluoroacetic Acid SCHEMBL4089207 | 0.84 | DYRK3 (0.39) | CISD1ALDH1A1NPC1RAB9AMEN1 | |
| Trifluoroacetic Acid SCHEMBL4089200 | 0.84 | DYRK3 (0.39) | CISD1ALDH1A1NPC1RAB9AMEN1 | |
| SCHEMBL4586165 | 0.83 | RAB9A (0.37) | CISD1NPC1RAB9ASMN1; SMN2MEN1 | |
| Trifluoroacetic Acid SCHEMBL2988374 | 0.83 | MEN1 (0.47) | ALDH1A1MEN1KMT2AMAPTLMNA | |
| Trifluoroacetic Acid SCHEMBL5048553 | 0.83 | MEN1 (0.47) | ALDH1A1MEN1KMT2AMAPTLMNA |
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-20080214455-A1 | Novel Chemical Compounds | SMITHKLINE BEECHAM CORPORATION | 2008-09-04 | — | — | 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-20080214455-A1 | Novel Chemical Compounds | HIPK3, HIPK1, HIPK4 | CISD1 3112/4885ALDH1A1 4089/4885NPC1 2040/4885 |
“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.