Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 4/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.41 |
| ▸ | TYR | P14679 | 3/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.41 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | MIF | P14174 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | ATP2A2 | P16615 | 1/20 | 0.38 |
| ▸ | ATP2A3 | Q93084 | 1/20 | 0.38 |
| ▸ | ESR1 | P03372 | 5/20 | 0.37 |
| ▸ | ESR2 | Q92731 | 5/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL1860672 | 0.86 | SMN1; SMN2 (0.46) | ALDH1A1ALOX15CYP2C9TYRHSD17B10 | |
| SCHEMBL28497299 | 0.84 | ALDH1A1 (0.41) | ALDH1A1ALOX15CYP2C9TYRHSD17B10 | |
| SCHEMBL11782380 | 0.84 | ALDH1A1 (0.41) | ALDH1A1ALOX15CYP2C9TYRHSD17B10 | |
| SCHEMBL648577 | 0.78 | ESR1 (0.47) | ALDH1A1TYRHSD17B10KDM4EESR1 | |
| SCHEMBL29808702 | 0.76 | ALDH1A1 (0.48) | ALDH1A1ALOX15CYP2C9TYRHSD17B10 | |
| SCHEMBL1080898 | 0.76 | ALDH1A1 (0.48) | ALDH1A1ALOX15CYP2C9TYRHSD17B10 | |
| SCHEMBL31243575 | 0.76 | ALDH1A1 (0.41) | ALDH1A1ALOX15CYP2C9TYRHSD17B10 | |
| SCHEMBL2321269 | 0.74 | HTR1D (0.46) | ALDH1A1TYRHSD17B10TDP1KDM4E | |
| SCHEMBL27825271 | 0.74 | CA2 (0.52) | ALDH1A1ALOX15CYP2C9TYRHSD17B10 | |
| SCHEMBL10589896 | 0.73 | ALDH1A1 (0.56) | ALDH1A1ALOX15CYP2C9TYRHSD17B10 |
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 13 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4139544-A | Oxidative coupling of alkylphenols catalyzed by metal complexes of polyimino acids | ICI AMERICAS INC. (US) | 1979-02-13 | — | — | US | disclosed |
| US-4132722-A | Oxidative coupling of alkylphenols catalyzed by metal complexes of diimino acid | ICI AMERICAS INC. (US) | 1979-01-02 | — | — | US | disclosed |
| US-4108908-A | Oxidative coupling of alkylphenols or 1-naphthols catalyzed by metal complexes of thio-acid compounds | ICI AMERICAS INC. (US) | 1978-08-22 | — | — | US | disclosed |
| US-4101561-A | Oxidative coupling of alkylphenols catalyzed by metal complexes of imino acid compounds | ICI AMERICAS INC. (US) | 1978-07-18 | — | — | US | disclosed |
| US-4100205-A | Oxidative coupling of alkylphenols or 1-naphthols catalyzed by metal complexes of aminoketo compounds | ICI AMERICAS INC. (US) | 1978-07-11 | — | — | US | disclosed |
| US-4100206-A | Oxidative coupling of alkylphenols or 1-naphthols catalyzed by metal complexes of keto alcohol compounds | ICI AMERICAS INC. (US) | 1978-07-11 | — | — | US | disclosed |
| US-4100202-A | Oxidative coupling of alkylphenols or 1-naphthols catalyzed by cupric complexes | ICI AMERICAS INC. (US) | 1978-07-11 | — | — | US | disclosed |
| US-4100203-A | Oxidative coupling of alkylphenols or 1-naphthols catalyzed by metal complexes of an oxime of a keto or aldehyde compound | ICI AMERICAS INC. (US) | 1978-07-11 | — | — | US | disclosed |
| US-4100204-A | Oxidative coupling of alkylphenols or 1-naphthols catalyzed by metal complexes of a hydroxy- or keto-acid compound | ICI AMERICAS INC. (US) | 1978-07-11 | — | — | US | disclosed |
| US-4098830-A | OXIDATIVE COUPLING OF ALKYLPHENOLS OR 1-NAPHTHOLS CATALYZED BY METAL COMPLEXES OF DICARBOXYLIC ACID COMPOUNDS | ICI AMERICAS INC. (US) | 1978-07-04 | — | — | US | disclosed |
| US-4097461-A | Oxidative coupling of alkylphenols or 1-naphthols catalyzed by metal complexes of diketo compounds | ICI AMERICAS INC. (US) | 1978-06-27 | — | — | US | disclosed |
| US-4096190-A | Oxidative coupling of alkylphenols catalyzed by metal ammonia complexes | ICI AMERICAS INC. (US) | 1978-06-20 | — | — | US | disclosed |
| US-4085124-A | Oxidative coupling of alkylphenols, alkoxyphenols and 1-naphthols catalyzed by metal complexes of amino compounds | ICI AMERICAS INC. (US) | 1978-04-18 | — | — | US | disclosed |