Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.39 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.39 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.39 |
| ▸ | SLC22A3 | O75751 | 1/20 | 0.39 |
| ▸ | HTR3B | O95264 | 1/20 | 0.39 |
| ▸ | PLAU | P00749 | 1/20 | 0.39 |
| ▸ | HTR3A | P46098 | 1/20 | 0.39 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.39 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CES2 | O00748 | 2/20 | 0.38 |
| ▸ | CES1 | P23141 | 2/20 | 0.38 |
| ▸ | DAO | P14920 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL342606 | 0.78 | TRPA1 (0.46) | TRPA1ALDH1A1HTR3ESLC22A2SLC22A1 | |
| SCHEMBL4993304 | 0.78 | TRPA1 (0.46) | TRPA1ALDH1A1HTR3ESLC22A2SLC22A1 | |
| SCHEMBL4829863 | 0.76 | TRPA1 (0.44) | TRPA1ALDH1A1HTR3ESLC22A2SLC22A1 | |
| SCHEMBL10681124 | 0.75 | TDP1 (0.47) | ALDH1A1HTR3ESLC22A2SLC22A1SLC22A3 | |
| SCHEMBL54470 | 0.74 | HTR3E (0.50) | TRPA1ALDH1A1HTR3ESLC22A2SLC22A1 | |
| SCHEMBL834716 | 0.74 | NOS3 (0.48) | TRPA1ALDH1A1HTR3ESLC22A2SLC22A1 | |
| SCHEMBL9333342 | 0.72 | HTR3E (0.48) | TRPA1ALDH1A1HTR3ESLC22A2SLC22A1 | |
| SCHEMBL2329631 | 0.72 | CES1 (0.48) | TRPA1ALDH1A1CES2CES1DAO | |
| SCHEMBL5681700 | 0.70 | F2 (0.42) | TRPA1ALDH1A1HTR3ESLC22A2SLC22A1 | |
| Azobenzene SCHEMBL9435350 | 0.69 | ALDH1A1 (0.75) | TRPA1ALDH1A1CYP1A2TSHRL3MBTL1 |
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 16 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20100279936-A1 | SUBSTITUTED ACETYLENIC COMPOUNDS USEFUL FOR THE TREATMENT OF DISEASES | LEO PHARMA A/S (DK) | 2010-11-04 | — | — | US | claimed |
| EP-2061449-A1 | SUBSTITUTED ACETYLENIC COMPOUNDS USEFUL FOR THE TREATMENT OF DISEASES | Leo Pharma A/S (DK) | 2009-05-27 | — | — | EP | claimed |
| WO-2008019690-A1 | SUBSTITUTED ACETYLENIC COMPOUNDS USEFUL FOR THE TREATMENT OF DISEASES | LEO PHARMA A/S (DK) | 2008-02-21 | — | — | WO | claimed |
| US-20100279936-A1 | SUBSTITUTED ACETYLENIC COMPOUNDS USEFUL FOR THE TREATMENT OF DISEASES | LEO PHARMA A/S (DK) | 2010-11-04 | — | — | US | disclosed |
| EP-2061449-A1 | SUBSTITUTED ACETYLENIC COMPOUNDS USEFUL FOR THE TREATMENT OF DISEASES | Leo Pharma A/S (DK) | 2009-05-27 | — | — | EP | disclosed |
| WO-2008019690-A1 | SUBSTITUTED ACETYLENIC COMPOUNDS USEFUL FOR THE TREATMENT OF DISEASES | LEO PHARMA A/S (DK) | 2008-02-21 | — | — | WO | disclosed |
| US-4236015-A | ANTIINFLAMMATORY AGENTS, IMMUNOSUPPRESSANTS, FUNGICIDES | WESTWOOD PHARMACEUTICALS, INC. (US) | 1980-11-25 | — | — | US | disclosed |
| US-4229452-A | Treatment of inflammatory disorders with 4-trifluoromethylimidazo[1,2-a]quinoxaline | WESTWOOD PHARMACEUTICALS, INC. | 1980-10-21 | — | — | US | disclosed |
| US-4225724-A | IMMUNOSUPPRESSANT ACTIVITY | WESTWOOD PHARMACEUTICALS, INC. (US) | 1980-09-30 | — | — | US | disclosed |
| US-4200750-A | ANTIINFLAMMATORY AGENTS, FUNGICIDES, ANTIBODY INHIBITORS | WESTWOOD PHARMACEUTICALS INC. (US) | 1980-04-29 | — | — | US | disclosed |
| US-4198508-A | CYCLIZATION OF 1-(2-ACYLAMINOPHENYL)IMIDAZOLES USING PHOSPHORUS OXYCHLORIDE OR POLYPHOSPHORIC ACID | WESTWOOD PHARMACEUTICALS INC. (US) | 1980-04-15 | — | — | US | disclosed |
| US-4197403-A | ANTIINFLAMMATORY, IMMUNOSUPPRESSIVE, FUNGICIDE | WESTWOOD PHARMACEUTICALS INC. (US) | 1980-04-08 | — | — | US | disclosed |
| US-4191766-A | 4-(SUBSTITUTED PHENYL OR ANILINO)IMIDAZO(1,2-A)QUINOXALINES | WESTWOOD PHARMACEUTICALS, INC. (US) | 1980-03-04 | — | — | US | disclosed |
| US-4191767-A | Method for treating fungal infection in mammals with imidazo [1,2-a]quinoxalines | WESTWOOD PHARMACEUTICALS, INC. (US) | 1980-03-04 | — | — | US | disclosed |
| US-4172947-A | IMMUNOSUPRESSANTS, AMTIIMFLAMMATORY AGENTS, FUNGICIDES | WESTWOOD PHARMACEUTICALS, INC. (US) | 1979-10-30 | — | — | US | disclosed |
| US-4160097-A | INTERMEDIATES FOR FUNGICIDAL AND ANTIINFLAMMATORY 4-SUBSTITUTED IMIDAZO(1,2-A)QUINOXALINES | WESTWIND PHARMACEUTICALS, INC. (US) | 1979-07-03 | — | — | 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-20100279936-A1 | SUBSTITUTED ACETYLENIC COMPOUNDS USEFUL FOR THE TREATMENT OF DISEASES | C1R, C3AR1, PTH1R | TRPA1 3012/4885ALDH1A1 1976/4885HTR3E 2436/4885 |
“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.