Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.54 |
| ▸ | TSHR | P16473 | 3/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.54 |
| ▸ | USP2 | O75604 | 1/20 | 0.54 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.42 |
| ▸ | RARA | P10276 | 1/20 | 0.40 |
| ▸ | RARB | P10826 | 1/20 | 0.40 |
| ▸ | RARG | P13631 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | CSF1R | P07333 | 5/20 | 0.39 |
| ▸ | PRKAG1 | P54619 | 1/20 | 0.38 |
| ▸ | PRKAA1 | Q13131 | 1/20 | 0.38 |
| ▸ | PRKAB1 | Q9Y478 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | CASP1 | P29466 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL5204512 | 0.89 | KDM4E (0.43) | ALDH1A1TSHRKDM4EUSP2HCAR2 | |
| SCHEMBL8137248 | 0.85 | NOTUM (0.47) | ALDH1A1TSHRKDM4EUSP2KMT2A | |
| SCHEMBL8138255 | 0.84 | ALDH1A1 (0.49) | ALDH1A1TSHRKDM4EUSP2HCAR2 | |
| SCHEMBL8135897 | 0.83 | ALDH1A1 (0.48) | ALDH1A1TSHRKDM4EUSP2HCAR2 | |
| SCHEMBL7988196 | 0.80 | KDM4E (0.50) | ALDH1A1TSHRKDM4EUSP2HCAR2 | |
| SCHEMBL5204516 | 0.77 | ALDH1A1 (0.35) | ALDH1A1TSHRKDM4EUSP2KMT2A | |
| SCHEMBL27513006 | 0.77 | ALDH1A1 (0.74) | ALDH1A1TSHRKDM4EUSP2HCAR2 | |
| SCHEMBL8377155 | 0.76 | NTRK1 (0.35) | ALDH1A1TSHRKDM4EUSP2KMT2A | |
| SCHEMBL8306233 | 0.75 | SMN1; SMN2 (0.39) | ALDH1A1TSHRKDM4EUSP2KMT2A | |
| SCHEMBL8522694 | 0.75 | ALDH1A1 (0.42) | ALDH1A1TSHRKDM4ERARARARB |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5948917-A | INTERMEDIATE FOR THE PRODUCTION OF A HERBICIDALLY ACTIVE PYRAZOLE COMPOUND | NIPPON SODA CO., LTD. (JP) | 1999-09-07 | — | — | US | claimed |
| EP-0891972-A1 | 3-(ISOXAZOL-5-YL)-SUBSTITUTED BENZOIC ACID DERIVATIVES AND PROCESS FOR PRODUCING THE SAME | NIPPON SODA CO., LTD. (JP) | 1999-01-20 | — | — | EP | claimed |
| EP-0958292-B1 | 4-(3-HETEROCYCLYL-1-BENZOYL)PYRAZOLES AND THEIR USE AS HERBICIDES | BASF AG (DE) | 2007-01-03 | — | — | EP | disclosed |
| US-6165944-A | 4-(3-heterocyclyl-1-benzoyl) pyrazoles and their use as herbicides | BASF AKTIENGESELLSCHAFT (DE) | 2000-12-26 | — | — | US | disclosed |
| US-6100421-A | METHYL 3-FORMYL-4-METHANESULFONYL-2-METHYLBENZOATE, USEFUL AS A STARTING MATERIAL FOR HERBICIDE MANUFACTURE | NIPPON SODA CO., LTD. (JP) | 2000-08-08 | — | — | US | disclosed |
| US-5948917-A | INTERMEDIATE FOR THE PRODUCTION OF A HERBICIDALLY ACTIVE PYRAZOLE COMPOUND | NIPPON SODA CO., LTD. (JP) | 1999-09-07 | — | — | US | disclosed |
| EP-0894792-A1 | HETEROCYCLE-SUBSTITUTED BENZENE DERIVATIVES AND HERBICIDES | NIPPON SODA CO., LTD. (JP) | 1999-02-03 | — | — | EP | disclosed |
| EP-0891972-A1 | 3-(ISOXAZOL-5-YL)-SUBSTITUTED BENZOIC ACID DERIVATIVES AND PROCESS FOR PRODUCING THE SAME | NIPPON SODA CO., LTD. (JP) | 1999-01-20 | — | — | EP | disclosed |