Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | GAA | P10253 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9711153 | 1.00 | ALDH1A1 (0.34) | ALDH1A1MEN1GAAMAPTKMT2A | |
| SCHEMBL10758618 | 0.90 | ALDH1A1 (0.38) | ALDH1A1MEN1GAAMAPTKMT2A | |
| SCHEMBL27970152 | 0.79 | INMT (0.41) | ALDH1A1MEN1GAAMAPTKMT2A | |
| SCHEMBL9331887 | 0.72 | MAPK1 (0.46) | ALDH1A1MEN1GAAMAPTKMT2A | |
| SCHEMBL9331882 | 0.72 | MAPK1 (0.46) | ALDH1A1MEN1GAAMAPTKMT2A | |
| SCHEMBL10362435 | 0.72 | MEN1 (0.31) | ALDH1A1MEN1GAAMAPTKMT2A | |
| SCHEMBL2593743 | 0.71 | — | — | |
| SCHEMBL7999137 | 0.70 | SMN1; SMN2 (0.51) | ALDH1A1NPSR1 | |
| SCHEMBL7999133 | 0.70 | SMN1; SMN2 (0.51) | ALDH1A1NPSR1 | |
| SCHEMBL11708139 | 0.70 | SMN1; SMN2 (0.51) | ALDH1A1NPSR1 |
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-4006156-A | 3-Alkyl-2-(nitromethylene) thiazolidine | SHELL OIL COMPANY (US) | 1977-02-01 | — | — | US | claimed |
| EP-0134615-B1 | PROCESS FOR PREPARING N-SUBSTITUTED NITROMETHYLENE HETEROCYCLIC COMPOUNDS | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1992-11-04 | — | — | EP | disclosed |
| EP-0115323-B1 | PROCESS FOR PRODUCING HETEROCYCLIC COMPOUND HAVING NITROMETHYLENE GROUP AS THE SIDE CHAIN GROUP | UBE INDUSTRIES, LTD. (JP) | 1990-08-29 | — | — | EP | disclosed |
| US-4006156-A | 3-Alkyl-2-(nitromethylene) thiazolidine | SHELL OIL COMPANY (US) | 1977-02-01 | — | — | US | disclosed |
| US-4006156-A | 3-Alkyl-2-(nitromethylene) thiazolidine | SHELL OIL COMPANY (US) | 1977-02-01 | — | — | US | disclosed |
| US-4006156-A | 3-Alkyl-2-(nitromethylene) thiazolidine | SHELL OIL COMPANY (US) | 1977-02-01 | — | — | US | disclosed |