Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.48 |
| ▸ | ESR1 | P03372 | 2/20 | 0.46 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.43 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.43 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.42 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.41 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.41 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.41 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.41 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.41 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.41 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL41959 | 0.86 | ALDH1A1 (0.50) | ALDH1A1ALOX15ESR1ESR2CYP3A4 | |
| Hydrogen Peroxide SCHEMBL27577220 | 0.85 | ALDH1A1 (0.55) | ALDH1A1ALOX15ESR1ESR2CYP3A4 | |
| SCHEMBL96177 | 0.82 | MAPK1 (0.55) | ALDH1A1ALOX15ESR1ESR2CYP3A4 | |
| SCHEMBL28174698 | 0.80 | ALDH1A1 (0.50) | ALDH1A1ALOX15ESR1ESR2CYP3A4 | |
| Hydrogen Peroxide SCHEMBL5702269 | 0.80 | ALDH1A1 (0.50) | ALDH1A1ALOX15ESR1ESR2CYP3A4 | |
| SCHEMBL7864858 | 0.79 | MAPK1 (0.52) | ALDH1A1ALOX15ESR1ESR2CYP3A4 | |
| SCHEMBL4082774 | 0.78 | ALDH1A1 (0.48) | ALDH1A1ALOX15ESR1ESR2CYP3A4 | |
| SCHEMBL29199451 | 0.78 | ALDH1A1 (0.48) | ALDH1A1ALOX15ESR1ESR2CYP3A4 | |
| Bicarbonate SCHEMBL28135106 | 0.78 | MAPT (0.56) | ALDH1A1ALOX15ESR1ESR2CYP3A4 | |
| SCHEMBL27652170 | 0.78 | ALDH1A1 (0.48) | ALDH1A1ALOX15ESR1ESR2CYP3A4 |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3218425-B1 | SILICONE COMPOUNDS | PROCTER & GAMBLE (US) | 2020-05-13 | — | — | EP | disclosed |
| EP-3572449-A1 | SILICONE COMPOUNDS | The Procter & Gamble Company (US) | 2019-11-27 | — | — | EP | disclosed |
| WO-2018116072-A1 | HETEROCYCLIC COMPOUNDS | PI INDUSTRIES LTD. (IN) | 2018-06-28 | — | — | WO | disclosed |
| US-20120141513-A1 | DEUTERATED FINGOLIMOD | CONCERT PHARMACEUTICALS INC. | 2012-06-07 | — | — | US | disclosed |
| US-20090176744-A1 | Deuterated fingolimod | CONCERT PHARMACEUTICALS, INC. (US) | 2009-07-09 | — | — | US | disclosed |
| US-7312209-B2 | Acridone inhibitors of IMPDH enzyme | BRISTOL-MYERS SQUIBB COMPANY (US) | 2007-12-25 | — | — | US | disclosed |
| US-7312209-B2 | Acridone inhibitors of IMPDH enzyme | BRISTOL-MYERS SQUIBB COMPANY (US) | 2007-12-25 | — | — | US | disclosed |
| US-7205324-B2 | Inhibitors of IMPDH enzyme | BRISTOL-MYERS SQUIBB COMPANY (US) | 2007-04-17 | — | — | US | disclosed |
| US-7205324-B2 | Inhibitors of IMPDH enzyme | BRISTOL-MYERS SQUIBB COMPANY (US) | 2007-04-17 | — | — | 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-20120141513-A1 | DEUTERATED FINGOLIMOD | S1PR1, S1PR3, S1PR4 | ALDH1A1 2873/4885ALOX15 944/4885ESR1 1872/4885 |
| US-20090176744-A1 | Deuterated fingolimod | S1PR1, S1PR3, S1PR4 | ALDH1A1 2873/4885ALOX15 944/4885ESR1 1872/4885 |
“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.