Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.56 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.56 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.54 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.54 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.54 |
| ▸ | ATM | Q13315 | 1/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.49 |
| ▸ | CRHBP | P24387 | 1/20 | 0.48 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 5/20 | 0.48 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.48 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.48 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.48 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.48 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.48 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.48 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL2606235 | 1.00 | ALDH1A1 (0.56) | ALDH1A1HSD17B10TDP1CYP3A4CYP1A2 | |
| SCHEMBL25075046 | 1.00 | ALDH1A1 (0.56) | ALDH1A1HSD17B10TDP1CYP3A4CYP1A2 | |
| SCHEMBL9146862 | 0.82 | CYP3A4 (0.59) | ALDH1A1HSD17B10TDP1CYP3A4CYP1A2 | |
| SCHEMBL2524856 | 0.80 | ALDH1A1 (0.61) | ALDH1A1HSD17B10TDP1CYP3A4CYP1A2 | |
| SCHEMBL7237921 | 0.80 | CYP1A2 (0.57) | ALDH1A1HSD17B10TDP1CYP3A4CYP1A2 | |
| SCHEMBL1254172 | 0.80 | ALDH1A1 (0.61) | ALDH1A1HSD17B10TDP1CYP3A4CYP1A2 | |
| SCHEMBL9609537 | 0.80 | CYP1A2 (0.57) | ALDH1A1HSD17B10TDP1CYP3A4CYP1A2 | |
| SCHEMBL28491533 | 0.79 | CYP3A4 (0.56) | ALDH1A1HSD17B10TDP1CYP3A4CYP1A2 | |
| SCHEMBL7820555 | 0.79 | CYP1A2 (0.63) | ALDH1A1HSD17B10TDP1CYP3A4CYP1A2 | |
| SCHEMBL25075069 | 0.79 | ALDH1A1 (0.54) | ALDH1A1HSD17B10TDP1CYP3A4CYP1A2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2468276-B1 | Nitrostyrene derivatives having antimicrobial action | BIODIEM LTD (AU) | 2015-11-11 | — | — | EP | disclosed |
| US-8158664-B2 | Antimicrobial and radioprotective compounds | BIODIEM LTD. (AU) | 2012-04-17 | — | — | US | disclosed |
| US-20100292317-A1 | ANTIMICROBIAL AND RADIOPROTECTIVE COMPOUNDS | BIODIEM LTD. (AU) | 2010-11-18 | — | — | US | disclosed |
| US-20090012137-A1 | administering microbiocides such as 3,4-methylenedioxy- beta -nitrostyrene, for the treatment of urogenital disorders caused by Candida, Neisseria, Chlamydia or Trichomonas; side effect reduction of radiotherapy | BIODIEM LTD. (AU) | 2009-01-08 | — | — | 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 (2 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-20100292317-A1 | ANTIMICROBIAL AND RADIOPROTECTIVE COMPOUNDS | RAD51, BRCA1, XPA | ALDH1A1 1984/4885HSD17B10 3083/4885TDP1 620/4885 |
| US-20090012137-A1 | administering microbiocides such as 3,4-methylenedioxy- beta -nitrostyrene, for the treatment of urogenital disorders caused by Candida, Neisseria, Chlamydia or Trichomonas; side effect reduction of radiotherapy | TUBB1, UGT1A1, CYP1A1 | ALDH1A1 770/4885HSD17B10 1395/4885TDP1 188/4885 |
“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.