SCHEMBL5437894

SCHEMBL5437894

Nc1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(C(=O)O)c1

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.50
SLC28A3 Q9HAS3 3/20 0.49
KMT2A Q03164 2/20 0.49
SNCA P37840 1/20 0.49
MEN1 O00255 1/20 0.49
SLC5A1 P13866 1/20 0.48
SLC5A2 P31639 1/20 0.48
TYR P14679 1/20 0.48
PPARG P37231 1/20 0.47
PPARD Q03181 1/20 0.47
PPARA Q07869 1/20 0.47
GAA P10253 1/20 0.47
TDP1 Q9NUW8 1/20 0.47

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.

Compoundsimilaritytop predictedshared targets
SCHEMBL5427804 1.00 ACHE (0.50) ACHESLC28A3KMT2ASNCAMEN1
SCHEMBL5427382 1.00 ACHE (0.50) ACHESLC28A3KMT2ASNCAMEN1
SCHEMBL17873961 1.00 ACHE (0.50) ACHESLC28A3KMT2ASNCAMEN1
SCHEMBL27932802 0.90 SLC28A3 (0.49) ACHESLC28A3SNCATYRGAA
SCHEMBL5431937 0.87 SNCA (0.57) ACHESLC28A3KMT2ASNCAMEN1
SCHEMBL5428987 0.87 SNCA (0.57) ACHESLC28A3KMT2ASNCAMEN1
SCHEMBL5435886 0.87 SNCA (0.57) ACHESLC28A3KMT2ASNCAMEN1
SCHEMBL4636845 0.86 TYR (0.59) ACHESLC28A3SLC5A1SLC5A2TYR
SCHEMBL8659653 0.82 SLC5A2 (0.64) SLC28A3KMT2AMEN1SLC5A1SLC5A2
SCHEMBL14164007 0.82 SLC5A2 (0.64) SLC28A3KMT2AMEN1SLC5A1SLC5A2

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070173461-A1 Glycoside prodrug of 5- aminosalicylic acid NIPPON SHINYAKU CO., LTD. (JP) 2007-07-26 US claimed
EP-1712555-A1 PRODRUG COMPRISING 5-AMINOSALICYLATE GLYCOSIDE Nippon Shinyaku Co., Ltd. (JP) 2006-10-18 EP claimed
US-20070173461-A1 Glycoside prodrug of 5- aminosalicylic acid NIPPON SHINYAKU CO., LTD. (JP) 2007-07-26 US disclosed
US-20070173461-A1 Glycoside prodrug of 5- aminosalicylic acid NIPPON SHINYAKU CO., LTD. (JP) 2007-07-26 US disclosed
US-20070173461-A1 Glycoside prodrug of 5- aminosalicylic acid NIPPON SHINYAKU CO., LTD. (JP) 2007-07-26 US disclosed
EP-1712555-A1 PRODRUG COMPRISING 5-AMINOSALICYLATE GLYCOSIDE Nippon Shinyaku Co., Ltd. (JP) 2006-10-18 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 (1 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.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070173461-A1 Glycoside prodrug of 5- aminosalicylic acid SI, FUT5, GALE ACHE 1092/4885SLC28A3 2961/4885KMT2A 4284/4885

“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.