SCHEMBL2008176

SCHEMBL2008176

CCOC(=O)COc1ccc(C(=O)CNC(=O)OC(C)(C)C)cc1OCC(=O)OCC

nearest known ligand 0.57

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.44
MEN1 O00255 2/20 0.44
ITGB3 P05106 4/20 0.42
ITGA2B P08514 4/20 0.42
ALDH1A1 P00352 2/20 0.42
GAA P10253 1/20 0.42
MAPK1 P28482 1/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
ESR1 P03372 1/20 0.40
MAPT P10636 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38

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
SCHEMBL2007999 0.90 GAA (0.44) KMT2AMEN1ALDH1A1GAAMAPK1
SCHEMBL2013251 0.88 GAA (0.39) KMT2AMEN1ALDH1A1GAAMAPK1
SCHEMBL2014829 0.88 L3MBTL1 (0.44) KMT2AMEN1ITGB3ITGA2BL3MBTL1
SCHEMBL2012807 0.87 NPC1 (0.44) KMT2AMEN1ALDH1A1GAAMAPK1
SCHEMBL2007940 0.87 NPC1 (0.42) KMT2AMEN1ALDH1A1GAAMAPK1
SCHEMBL2011176 0.87 ITGB3 (0.54) KMT2AMEN1ITGB3ITGA2BL3MBTL1
SCHEMBL2010623 0.83 MAPK1 (0.36) KMT2AMEN1ALDH1A1GAAMAPK1
SCHEMBL2012428 0.81 HPGD (0.45) KMT2AMEN1ALDH1A1GAAMAPK1
Hydrochloric Acid SCHEMBL8836093 0.81 ALDH1A1 (0.43) KMT2AMEN1ITGB3ITGA2BALDH1A1
SCHEMBL2011589 0.80 CASP7 (0.40) KMT2AMEN1ALDH1A1GAAMAPK1

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
US-7759387-B2 Fibrinogen receptor antagonists and their use PIRAMAL LIFE SCIENCES LIMITED (IN) 2010-07-20 US disclosed
US-20070021489-A1 Fibrinogen receptor antagonists and their use NICHOLAS PIRAMAL INDIA LIMITED (IN) 2007-01-25 US 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 (2 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 KMT2A 4561/4885MEN1 4472/4885ITGB3 169/4885
US-20070021489-A1 Fibrinogen receptor antagonists and their use FGB, F13B, F2 KMT2A 4561/4885MEN1 4472/4885ITGB3 169/4885

“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.