Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SPHK1 | Q9NYA1 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | CA1 | P00915 | 2/20 | 0.36 |
| ▸ | CA2 | P00918 | 5/20 | 0.35 |
| ▸ | FDPS | P14324 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.34 |
| ▸ | GMNN | O75496 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | THPO | P40225 | 1/20 | 0.34 |
| ▸ | MTOR | P42345 | 1/20 | 0.34 |
| ▸ | BLM | P54132 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | CETP | P11597 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | UBE2N | P61088 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8355649 | 0.94 | SPHK1 (0.48) | SPHK1ALDH1A1CA1CYP2D6GMNN | |
| SCHEMBL6381582 | 0.92 | SPHK1 (0.52) | SPHK1ALDH1A1CA1CA2CYP2D6 | |
| SCHEMBL6380473 | 0.92 | SPHK1 (0.52) | SPHK1ALDH1A1CA1CA2CYP2D6 | |
| SCHEMBL15718783 | 0.92 | SPHK1 (0.52) | SPHK1ALDH1A1CA1CA2CYP2D6 | |
| SCHEMBL6381596 | 0.87 | LMNA (0.37) | SPHK1ALDH1A1CA1FDPSLMNA | |
| SCHEMBL17366581 | 0.87 | LMNA (0.37) | SPHK1ALDH1A1CA1FDPSLMNA | |
| SCHEMBL11874858 | 0.82 | ALDH1A1 (0.41) | ALDH1A1LMNABLM | |
| SCHEMBL11876607 | 0.81 | SPHK1 (0.41) | SPHK1ALDH1A1CA1CA2CYP2D6 | |
| SCHEMBL6341155 | 0.78 | — | — | |
| SCHEMBL1702828 | 0.78 | LCK (0.38) | SPHK1ALDH1A1CA2FDPSCYP2D6 |
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 15 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9988397-B2 | ERK inhibitors | MERCK SHARP & DOHME CORP. (US) | 2018-06-05 | — | — | US | disclosed |
| US-20170267695-A1 | ERK INHIBITORS | MERCK SHARP & DOHME CORP. (US) | 2017-09-21 | — | — | US | disclosed |
| EP-2117300-B1 | AMINOALCOHOL AND BIOCIDE COMPOSITIONS FOR AQUEOUS BASED SYSTEMS | ANGUS CHEMICAL (US) | 2017-04-19 | — | — | EP | disclosed |
| US-9034929-B2 | Aminoalcohol and biocide compositions for aqueous based systems | ANGUS CHEMICAL COMPANY (US) | 2015-05-19 | — | — | US | disclosed |
| US-20120311922-A1 | CORROSION AND MICROBIAL CONTROL IN HYDROCARBONACEOUS COMPOSITIONS | TINETTI SHEILA M (US) | 2012-12-13 | — | — | US | disclosed |
| EP-2244570-A2 | IMPROVED CORROSION AND MICROBIAL CONTROL IN HYDROCARBONACEOUS COMPOSITIONS | Dow Global Technologies Inc. (US) | 2010-11-03 | — | — | EP | disclosed |
| US-20100242341-A1 | CORROSION AND MICROBIAL CONTROL IN HYDROCARBONACEOUS COMPOSITIONS | DOW GLOBAL TECHNOLOGIES LLC | 2010-09-30 | — | — | US | disclosed |
| US-20100093736-A1 | AMINOALCOHOL AND BIOCIDE COMPOSITIONS FOR AQUEOUS BASED SYSTEMS | ANGUS CHEMICAL COMPANY (US) | 2010-04-15 | — | — | US | disclosed |
| EP-2117300-A2 | AMINOALCOHOL AND BIOCIDE COMPOSITIONS FOR AQUEOUS BASED SYSTEMS | ANGUS CHEMICAL COMPANY (US) | 2009-11-18 | — | — | EP | disclosed |
| WO-2009085552-A2 | IMPROVED CORROSION AND MICROBIAL CONTROL IN HYDROCARBONACEOUS COMPOSITIONS | DOW GLOBAL TECHNOLOGIES INC. (US) | 2009-07-09 | — | — | WO | disclosed |
| WO-2008088632-A2 | AMINOALCOHOL AND BIOCIDE COMPOSITIONS FOR AQUEOUS BASED SYSTEMS | ANGUS CHEMICAL COMPANY (US) | 2008-07-24 | — | — | WO | disclosed |
| EP-0976734-B1 | Selective inhibitors of viral or bacterial neuraminidase | GILEAD SCIENCES INC (US) | 2005-09-28 | — | — | EP | disclosed |
| US-20050176758-A1 | 2-(hydroxy or methoxymethoxy)-4-(carboxy or alkoxycarbonyl)-5-(fluoro or hydrogen)-7-oxabicyclo(4.1.0)hept-3-ene chemical intermediates to neuraminidase inhibitors | GILEAD SCIENCES, INC. | 2005-08-11 | — | — | US | disclosed |
| US-6225341-B1 | FOR INHIBITING NEURAMINIDASE; FOR THERAPY AND PROPHYLAXIS OF VIRUS INFECTION | GILEAD SCIENCES, INC. | 2001-05-01 | — | — | US | disclosed |
| EP-0759917-B1 | NOVEL SELECTIVE INHIBITORS OF VIRAL OR BACTERIAL NEURAMINIDASES | GILEAD SCIENCES INC (US) | 2000-04-12 | — | — | EP | disclosed |
Patent text — is the patent's own abstract consistent with the prediction?
For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.
| Patent | Title | Text reads most about | Predicted target · text-rank |
|---|---|---|---|
| US-20170267695-A1 | ERK INHIBITORS | MAPK1, MAP3K1, MAPK4 | SPHK1 207/4885ALDH1A1 331/4885CA1 3114/4885 |
| US-20100093736-A1 | AMINOALCOHOL AND BIOCIDE COMPOSITIONS FOR AQUEOUS BASED SYSTEMS | ADH1C, ADH1A, ADH5 | SPHK1 3286/4885ALDH1A1 31/4885CA1 1786/4885 |
| US-20050176758-A1 | 2-(hydroxy or methoxymethoxy)-4-(carboxy or alkoxycarbonyl)-5-(fluoro or hydrogen)-7-oxabicyclo(4.1.0)hept-3-ene chemical intermediates to neuraminidase inhibitors | NEU3, NEU1, NEU4 | SPHK1 2790/4885ALDH1A1 374/4885CA1 434/4885 |
“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.