Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | TP53 | P04637 | 2/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.32 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.32 |
| ▸ | GLA | P06280 | 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 | |
|---|---|---|---|---|
| SCHEMBL7193893 | 0.76 | — | — | |
| SCHEMBL8950934 | 0.74 | TSHR (0.38) | TSHRALDH1A1TDP1MAPK1SMN1; SMN2 | |
| SCHEMBL1825593 | 0.74 | TSHR (0.46) | TSHRALDH1A1TDP1MAPK1SMN1; SMN2 | |
| SCHEMBL9160069 | 0.71 | ALDH1A1 (0.42) | TSHRALDH1A1TDP1MAPK1SMN1; SMN2 | |
| SCHEMBL8718994 | 0.70 | ALDH1A1 (0.34) | TSHRALDH1A1MAPK1 | |
| SCHEMBL25210172 | 0.70 | TSHR (0.42) | TSHRALDH1A1TDP1MAPK1SMN1; SMN2 | |
| SCHEMBL3458576 | 0.70 | ALDH1A1 (0.46) | TSHRALDH1A1TDP1MAPK1SMN1; SMN2 | |
| SCHEMBL39030 | 0.70 | — | — | |
| SCHEMBL4542782 | 0.70 | ALDH1A1 (0.43) | TSHRALDH1A1TDP1MAPK1SMN1; SMN2 | |
| SCHEMBL2556581 | 0.70 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4237250-A | Polyurethanes containing aryl sulfonic acid alkyl ester groups | BAYER AKTIENGESELLSCHAFT (DE) | 1980-12-02 | — | — | US | disclosed |
| US-4211850-A | Polyhydroxy compounds containing urethane aryl sulfonic acid hydroxyalkyl ester groups | BAYER AKTIENGESELLSCHAFT (DE) | 1980-07-08 | — | — | US | disclosed |
| US-4201852-A | Polyurethanes based on modified polyisocyanates containing sulphonic acid ester groups and process for the production thereof | BAYER AKTIENGESELLSCHAFT (DE) | 1980-05-06 | — | — | US | disclosed |
| US-4189562-A | Polyhydroxy compounds containing urethane aryl sulfonic acid hydroxyalkyl ester groups | BAYER AKTIENGESELLSCHAFT (DE) | 1980-02-19 | — | — | US | disclosed |