Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM5 | P41594 | 1/20 | 0.45 |
| ▸ | PPARG | P37231 | 1/20 | 0.45 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.43 |
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | CA9 | Q16790 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | GLA | P06280 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.36 |
| ▸ | MEN1 | O00255 | 3/20 | 0.36 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.36 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.36 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6827371 | 0.83 | PPARG (0.41) | GRM5PPARGEGLN1CA12CA2 | |
| SCHEMBL14269510 | 0.79 | GRM5 (0.49) | GRM5PPARGEGLN1CA12CA2 | |
| SCHEMBL8331122 | 0.77 | GRM5 (0.53) | GRM5PPARGEGLN1CA12CA2 | |
| SCHEMBL22485593 | 0.75 | GRM5 (0.51) | GRM5PPARGEGLN1CA12CA2 | |
| SCHEMBL196635 | 0.72 | KMT2A (0.49) | CA12CA2CA9ALDH1A1GLA | |
| SCHEMBL6929485 | 0.72 | CA12 (0.47) | GRM5PPARGCA12CA2CA9 | |
| SCHEMBL19583155 | 0.72 | GRM5 (0.57) | GRM5PPARGEGLN1CA12CA2 | |
| SCHEMBL11973878 | 0.71 | KMT2A (0.47) | CA12CA2CA9ALDH1A1GLA | |
| SCHEMBL11973371 | 0.71 | KMT2A (0.47) | CA12CA2CA9ALDH1A1GLA | |
| Ethane SCHEMBL7405342 | 0.71 | KMT2A (0.47) | CA12CA2CA9ALDH1A1GLA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6743940-B2 | MICROBIOCIDES | CIBA SPECIALTY CHEMICALS CORPORATION | 2004-06-01 | — | — | US | disclosed |
| US-20020115881-A1 | 4-aminobut-2-ynecarboxylic acid derivatives | CIBA SPECIALTY CHEMICALS CORP. | 2002-08-22 | — | — | US | disclosed |
| EP-1215198-A1 | 4-Aminobut-2-yne carboxylic acid derivatives and their use as antimicrobial agents | Ciba SC Holding AG (CH) | 2002-06-19 | — | — | EP | 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-20020115881-A1 | 4-aminobut-2-ynecarboxylic acid derivatives | DDC, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, NDC1 | GRM5 3249/4885PPARG 1877/4885EGLN1 1460/4885 |
“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.