Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.38 |
| ▸ | TSHR | P16473 | 3/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | CASP1 | P29466 | 1/20 | 0.38 |
| ▸ | CLCN2 | P51788 | 1/20 | 0.38 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.37 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.37 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.37 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL2149018 | 0.85 | AKR1C2 (0.47) | ALDH1A1TSHRSMN1; SMN2TP53CASP1 | |
| SCHEMBL542774 | 0.82 | CYP3A4 (0.41) | CYP3A4ALDH1A1TSHRSMN1; SMN2TP53 | |
| SCHEMBL21519775 | 0.81 | MRGPRX4 (0.36) | CYP3A4ALDH1A1TSHRSMN1; SMN2TP53 | |
| SCHEMBL4617979 | 0.78 | AKR1C2 (0.47) | CYP3A4ALDH1A1TSHRSMN1; SMN2CLCN2 | |
| SCHEMBL10397526 | 0.77 | TSHR (0.47) | ALDH1A1TSHRSMN1; SMN2TP53CASP1 | |
| SCHEMBL8743543 | 0.77 | CYP3A4 (0.41) | CYP3A4ALDH1A1TSHRSMN1; SMN2TP53 | |
| SCHEMBL1437003 | 0.74 | CYP3A4 (0.48) | CYP3A4ALDH1A1TSHRSMN1; SMN2TP53 | |
| SCHEMBL23531201 | 0.74 | ALDH1A1 (0.36) | ALDH1A1TSHRSMN1; SMN2TP53CASP1 | |
| SCHEMBL30280779 | 0.74 | ALDH1A1 (0.36) | ALDH1A1TSHRSMN1; SMN2TP53CASP1 | |
| SCHEMBL8856970 | 0.74 | CLCN2 (0.40) | ALDH1A1TSHRSMN1; SMN2TP53CASP1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6303812-B1 | ADDING WATER TO A MIXTURE CONTAINING A CUPROUS HALIDE, CUPROUS ACETATE OR PROPIONATE, AND CERTAIN DEHALOGENATED AROMATIC PRODUCTS, SUCH AS METHYL 3,5-DICHLORO-4-METHYLBENZOATE, CAUSES THE MIXTURE TO SEPARATE INTO ORGANIC AND AQUEOUS PHASES | OCCIDENTAL CHEMICAL CORPORATION | 2001-10-16 | — | — | US | claimed |
| US-6303812-B1 | ADDING WATER TO A MIXTURE CONTAINING A CUPROUS HALIDE, CUPROUS ACETATE OR PROPIONATE, AND CERTAIN DEHALOGENATED AROMATIC PRODUCTS, SUCH AS METHYL 3,5-DICHLORO-4-METHYLBENZOATE, CAUSES THE MIXTURE TO SEPARATE INTO ORGANIC AND AQUEOUS PHASES | OCCIDENTAL CHEMICAL CORPORATION | 2001-10-16 | — | — | US | disclosed |