SCHEMBL2010525

SCHEMBL2010525

CCOC(=O)COc1ccc(C(=O)CN2Cc3cc(C(=O)NS)ccc3C2=O)cc1N(CC(=O)OCC)S(C)(=O)=O

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
AOC3 Q16853 2/20 0.35
MEN1 O00255 3/20 0.32
KMT2A Q03164 3/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
ITGB3 P05106 1/20 0.32
ITGA2B P08514 1/20 0.32
ALOX15 P16050 1/20 0.32
ALDH1A1 P00352 2/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
HSD17B10 Q99714 1/20 0.31
PTPN1 P18031 1/20 0.30
GAA P10253 1/20 0.30

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
SCHEMBL2007965 0.89 ITGB3 (0.34) AOC3MEN1KMT2AL3MBTL1ITGB3
SCHEMBL2008828 0.89 ITGB3 (0.34) AOC3MEN1KMT2AL3MBTL1ITGB3
SCHEMBL2010527 0.89 AOC3 (0.37) AOC3MEN1KMT2AL3MBTL1ITGB3
SCHEMBL2010747 0.89 ITGB3 (0.42) AOC3ITGB3ITGA2B
SCHEMBL2014790 0.85 AOC3 (0.32) AOC3ITGB3ITGA2B
SCHEMBL2008322 0.74 ALDH1A1 (0.39) L3MBTL1ALDH1A1HSD17B10GAA
SCHEMBL2007949 0.74 ALDH1A1 (0.39) L3MBTL1ALDH1A1HSD17B10GAA
SCHEMBL2011020 0.74 ITGB3 (0.38) AOC3MEN1KMT2AL3MBTL1ITGB3
SCHEMBL2009666 0.74 ITGB3 (0.38) AOC3MEN1KMT2AL3MBTL1ITGB3
SCHEMBL2009678 0.74 ITGB3 (0.47) AOC3MEN1KMT2AITGB3ITGA2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7964628-B2 Fibrinogen receptor antagonists and their use PIRAMAL LIFE SCIENCES LIMITED (IN) 2011-06-21 US disclosed
US-20100256161-A1 FIBRINOGEN RECEPTOR ANTAGONISTS AND THEIR USE PIRAMAL LIFE SCIENCES LIMITED (IN) 2010-10-07 US disclosed
EP-1677783-A2 FIBRINOGEN RECEPTOR ANTAGONISTS AND THEIR USE Nicholas Piramal India Limited (IN) 2006-07-12 EP disclosed
WO-2005035495-A2 FIBRINOGEN RECEPTOR ANTAGONISTS AND THEIR USE NICHOLAS PIRAMAL INDIA LIMITED (IN) 2005-04-21 WO 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-20100256161-A1 FIBRINOGEN RECEPTOR ANTAGONISTS AND THEIR USE FGB, F13B, F2 AOC3 3283/4885MEN1 4472/4885KMT2A 4561/4885

“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.