Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.48 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.47 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.46 |
| ▸ | DRD2 | P14416 | 2/20 | 0.46 |
| ▸ | DRD3 | P35462 | 2/20 | 0.46 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.46 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.46 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.46 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL10987471 | 0.84 | TSHR (0.51) | ALDH1A1KDM4EHSD17B10CYP17A1SMN1; SMN2 | |
| SCHEMBL10965901 | 0.81 | DRD2 (0.57) | ALDH1A1CYP17A1DRD2DRD3KCNH2 | |
| SCHEMBL10983305 | 0.80 | DRD2 (0.49) | GRM2DRD2DRD3KCNH2NPC1 | |
| SCHEMBL10967325 | 0.79 | ALDH1A1 (0.50) | ALDH1A1KDM4EMAPK1HSD17B10CYP17A1 | |
| SCHEMBL10666765 | 0.78 | MEN1 (0.46) | ALDH1A1KDM4EMAPK1HSD17B10GRM2 | |
| SCHEMBL10988754 | 0.77 | GRM2 (0.52) | ALDH1A1GRM2DRD2DRD3TP53 | |
| SCHEMBL10988555 | 0.76 | KMT2A (0.46) | ALDH1A1MAPK1HSD17B10SMN1; SMN2NPC1 | |
| SCHEMBL10666890 | 0.75 | DRD2 (0.46) | ALDH1A1GRM2CYP17A1DRD2DRD3 | |
| SCHEMBL10988185 | 0.73 | DRD2 (0.47) | ALDH1A1KDM4EMAPK1HSD17B10DRD2 | |
| SCHEMBL11281751 | 0.72 | DRD2 (0.52) | ALDH1A1KDM4EMAPK1HSD17B10CYP17A1 |
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 14 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4514210-A | Herbicidally active methyl-substituted tetrahydro-2-pyrimidinone derivatives | NIHON TOKUSHU NOYAKU SEIZO K.K. (JP) | 1985-04-30 | — | — | US | claimed |
| EP-0585970-B1 | Triazolin(thi)one intermediates for the preparation of herbicides | BAYER AG (DE) | 2000-10-18 | — | — | EP | disclosed |
| US-5750718-A | CHEMICAL INTERMEDIATES | BAYER AKTIENGESELLSCHAFT (DE) | 1998-05-12 | — | — | US | disclosed |
| EP-0790242-A1 | Substituted triazolinones | BAYER AG (DE) | 1997-08-20 | — | — | EP | disclosed |
| US-5599944-A | Intermediates for herbicidal sulphonylaminocarbonyltriazolinones having substituents which are bonded via sulphur | BAYER AKTIENGESELLSCHAFT (DE) | 1997-02-04 | — | — | US | disclosed |
| US-5523409-A | PREEMERGENCE, POSTEMERGENCE | BAYER AKTIENGESELLSCHAFT (DE) | 1996-06-04 | — | — | US | disclosed |
| EP-0283876-B1 | Substituted triazolinones | BAYER AG (DE) | 1994-07-20 | — | — | EP | disclosed |
| EP-0585970-A2 | Substituted triazolinones | BAYER AG (DE) | 1994-03-09 | — | — | EP | disclosed |
| US-5262389-A | Substituted triazolinone herbicides and plant growth regulators | BAYER AKTIENGESELLSCHAFT (DE) | 1993-11-16 | — | — | US | disclosed |
| US-5166356-A | Substituted triazolinone herbicides and plant growth regulators | BAYER AKTIENGESELLSCHAFT (DE) | 1992-11-24 | — | — | US | disclosed |
| US-5061311-A | SUBSTITUTED TRIAZOLINONE HERBICIDES AND PLANT GROWTH REGULATORS | BAYER AKTIENGESELLSCHAFT (DE) | 1991-10-29 | — | — | US | disclosed |
| EP-0283876-A2 | Substituted triazolinones | BAYER AG (DE) | 1988-09-28 | — | — | EP | disclosed |
| US-4514210-A | Herbicidally active methyl-substituted tetrahydro-2-pyrimidinone derivatives | NIHON TOKUSHU NOYAKU SEIZO K.K. (JP) | 1985-04-30 | — | — | US | disclosed |
| EP-0137358-A2 | 1,3-Diaryl-5-methylene-perhydropyrimidin-2-one | BAYER AG (DE) | 1985-04-17 | — | — | EP | disclosed |