Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SHBG | P04278 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.37 |
| ▸ | MAPT | P10636 | 3/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.37 |
| ▸ | USP2 | O75604 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | ESR1 | P03372 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | PGR | P06401 | 1/20 | 0.37 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.37 |
| ▸ | AR | P10275 | 1/20 | 0.37 |
| ▸ | DRD1 | P21728 | 1/20 | 0.37 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.37 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.37 |
| ▸ | PDE4A | P27815 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | CASP1 | P29466 | 1/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.37 |
| ▸ | OPRM1 | P35372 | 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 | |
|---|---|---|---|---|
| SCHEMBL9306032 | 0.82 | SHBG (0.39) | SHBGSMN1; SMN2MAPTCYP3A4USP2 | |
| SCHEMBL12805011 | 0.76 | BACE1 (0.42) | SMN1; SMN2KDM4EPIK3CGPSMB8PSMB5 | |
| SCHEMBL9304400 | 0.73 | KMT2A (0.49) | SHBGSMN1; SMN2MAPTCYP3A4USP2 | |
| SCHEMBL9305794 | 0.71 | HDAC4 (0.33) | SHBGMAPTCYP3A4TP53CYP2D6 | |
| SCHEMBL9305789 | 0.70 | MAPT (0.35) | SHBGMAPTTP53HDAC6 | |
| SCHEMBL18174921 | 0.70 | SMN1; SMN2 (0.43) | SMN1; SMN2MAPTCYP3A4MEN1KMT2A | |
| SCHEMBL9303891 | 0.70 | SCN10A (0.43) | SHBGSMN1; SMN2MAPTCYP3A4USP2 | |
| SCHEMBL2541637 | 0.70 | KDM4E (0.59) | SMN1; SMN2MAPTCYP3A4USP2MEN1 | |
| SCHEMBL9305682 | 0.69 | RAB9A (0.46) | SMN1; SMN2MAPTUSP2MEN1KMT2A | |
| SCHEMBL3068277 | 0.69 | FBP1 (0.50) | SMN1; SMN2MAPTMEN1KMT2AMAPK1 |
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-5347008-A | Thio(cyclo) alkanepolycarboxylic acids containing heterocyclic substituents | CIBA-GEIGY CORPORATION (US) | 1994-09-13 | — | — | US | disclosed |
| US-5152929-A | Corrosion inhibitors for water systems | CIBA-GEIGY CORPORATION (US) | 1992-10-06 | — | — | US | disclosed |
| EP-0129506-A2 | Heterocyclically substituted thio(cyclo)alkane polycarboxylic acids | CIBA-GEIGY AG (CH) | 1984-12-27 | — | — | EP | disclosed |