Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOTUM | Q6P988 | 2/20 | 0.38 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.38 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.37 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.37 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.37 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.36 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.36 |
| ▸ | IDO1 | P14902 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | HTR7 | P34969 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL10750583 | 0.81 | NPC1 (0.39) | NOTUMCHRNB4CHRNA3IDO1SMN1; SMN2 | |
| SCHEMBL10748422 | 0.80 | NOTUM (0.42) | NOTUMKDM4EIDO1 | |
| SCHEMBL1577055 | 0.79 | L3MBTL1 (0.32) | NOTUMMEN1MAPTKMT2ASMN1; SMN2 | |
| SCHEMBL10752120 | 0.75 | SMN1; SMN2 (0.64) | KDM4EMAPTKMT2AIDO1SMN1; SMN2 | |
| SCHEMBL8021934 | 0.72 | AHR (0.42) | NOTUMKDM4EMEN1MAPTKMT2A | |
| SCHEMBL10750163 | 0.70 | MAPT (0.37) | NOTUMKDM4EMAPTSMN1; SMN2 | |
| SCHEMBL10752085 | 0.69 | ALDH1A1 (0.32) | SMN1; SMN2 | |
| SCHEMBL8482382 | 0.69 | NOTUM (0.36) | NOTUMKDM4EMAPTSMN1; SMN2 | |
| SCHEMBL27995629 | 0.68 | KDM4E (0.40) | NOTUMHSD17B1HSD17B2KDM4ECHRNB4 | |
| SCHEMBL9105993 | 0.67 | NPC1 (0.56) | NOTUMSMN1; SMN2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4675044-A | DEFOLIANTS | UNIROYAL CHEMICAL COMPANY, INC. (US) | 1987-06-23 | — | — | US | disclosed |
| US-4569690-A | HERBICIDES, FUNGICIDES, PLANT DESSICANTS, DEFOLIANTS | UNIROYAL, INC. (US) | 1986-02-11 | — | — | US | disclosed |
| EP-0104940-A1 | 3-Aryl-5,6-dihydro-1,4,2-oxathiazines and their oxides | UNIROYAL, INC. (US) | 1984-04-04 | — | — | EP | disclosed |