Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | MAOB | P27338 | 2/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 3/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.39 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.38 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.38 |
| ▸ | MAOA | P21397 | 1/20 | 0.38 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | IDO1 | P14902 | 2/20 | 0.37 |
| ▸ | ESR1 | P03372 | 1/20 | 0.37 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.36 |
| ▸ | TNKS | O95271 | 1/20 | 0.36 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.36 |
| ▸ | HDAC7 | Q8WUI4 | 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 | |
|---|---|---|---|---|
| SCHEMBL434609 | 0.83 | ALDH1A1 (0.50) | ALDH1A1MAOBTSHRCYP2A6LMNA | |
| SCHEMBL6932980 | 0.83 | ALDH1A1 (0.38) | ALDH1A1MAOBTSHRCYP2A6LMNA | |
| SCHEMBL9444804 | 0.83 | ALDH1A1 (0.50) | ALDH1A1MAOBTSHRCYP2A6LMNA | |
| SCHEMBL9491570 | 0.81 | MAOB (0.48) | ALDH1A1MAOBLMNATRPA1NFE2L2 | |
| SCHEMBL4354058 | 0.75 | — | — | |
| SCHEMBL8 | 0.75 | — | — | |
| SCHEMBL6258234 | 0.75 | — | — | |
| SCHEMBL18640421 | 0.75 | — | — | |
| SCHEMBL3855904 | 0.75 | — | — | |
| SCHEMBL9798232 | 0.73 | ALDH1A1 (0.39) | ALDH1A1MAOBTSHRCYP2A6LMNA |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-3946064-A | EXPANDING POLYMERS | UNIROYAL, INC. (US) | 1976-03-23 | — | — | US | claimed |
| US-6696595-B2 | ESTERIFYING AN ADAMANTANE COMPOUND HAVING AN -OH GROUP, -OM GROUP OR OR DIVALENT ALIPHATIC HYDROCARBON GROUP, AND DISTILLING THE ESTER PRODUCT IN PRESENCE OF AN INERT HETEROCYCLIC COMPOUND WHICH IS STABLE UNDER DISTILLATION | TOKUYAMA CORPORATION (JP) | 2004-02-24 | — | — | US | disclosed |
| US-20030120107-A1 | Process of the preparation of high-purity alkyladamantyl esters | TOKUYAMA CORPORATION (JP) | 2003-06-26 | — | — | US | disclosed |
| EP-1284256-A1 | PROCESS OF THE PREPARATION OF HIGH-PURITY ALKYLADAMANTYL ESTERS | TOKUYAMA CORPORATION (JP) | 2003-02-19 | — | — | EP | disclosed |
| US-4245060-A | TOUGH, DURABLE COATINGS | EXXON RESEARCH & ENGINEERING CO. (US) | 1981-01-13 | — | — | US | disclosed |
| US-3946064-A | EXPANDING POLYMERS | UNIROYAL, INC. (US) | 1976-03-23 | — | — | 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-20030120107-A1 | Process of the preparation of high-purity alkyladamantyl esters | TET2, MSMO1, ACMSD | ALDH1A1 591/4885MAOB 2462/4885TSHR 4023/4885 |
“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.