Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | TP53 | P04637 | 2/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 8/20 | 0.38 |
| ▸ | CA1 | P00915 | 6/20 | 0.38 |
| ▸ | CA9 | Q16790 | 4/20 | 0.38 |
| ▸ | CA7 | P43166 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL26222203 | 0.77 | KMT2A (0.56) | ALDH1A1HSD17B10TSHRTP53MAPK1 | |
| SCHEMBL234461 | 0.76 | ALDH1A1 (0.58) | ALDH1A1HSD17B10TSHRTP53MAPK1 | |
| SCHEMBL16355131 | 0.76 | KDM4E (0.32) | ALDH1A1HSD17B10TP53MAPK1TDP1 | |
| SCHEMBL1109066 | 0.76 | CYP2A6 (0.48) | ALDH1A1HSD17B10TSHRTP53MAPK1 | |
| SCHEMBL28249128 | 0.74 | ALDH1A1 (0.46) | ALDH1A1HSD17B10TSHRTP53MAPK1 | |
| SCHEMBL13823021 | 0.74 | ALDH1A1 (0.58) | ALDH1A1HSD17B10TSHRTP53MAPK1 | |
| SCHEMBL23074232 | 0.72 | CA1 (0.36) | ALDH1A1MAPK1TDP1CYP3A4CA2 | |
| SCHEMBL28162394 | 0.70 | ALDH1A1 (0.65) | ALDH1A1HSD17B10TP53MAPK1TDP1 | |
| SCHEMBL12669932 | 0.70 | PARP10 (0.52) | ALDH1A1HSD17B10MAPTSMN1; SMN2KDM4E | |
| SCHEMBL12855366 | 0.70 | ALDH1A1 (0.46) | ALDH1A1HSD17B10TSHRTP53MAPK1 |
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-10888853-B2 | Cinchonium betaine catalysts and methods of using same | BRANDEIS UNIVERSITY (US) | 2021-01-12 | — | — | US | disclosed |
| US-20200147593-A1 | Cinchonium betaine catalysts and methods of using same | BRANDEIS UNIVERSITY | 2020-05-14 | — | — | 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-20200147593-A1 | Cinchonium betaine catalysts and methods of using same | NOTUM, SLC6A12, INMT | ALDH1A1 1590/4885HSD17B10 750/4885TSHR 4850/4885 |
| US-10888853-B2 | Cinchonium betaine catalysts and methods of using same | NOTUM, SLC6A12, INMT | ALDH1A1 1590/4885HSD17B10 750/4885TSHR 4850/4885 |
“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.