SCHEMBL2006182

SCHEMBL2006182

CCOC(=O)COc1ccc(C(=O)CN2Cc3cc(C(=N)SC)ccc3C2=O)c(OC)c1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 1/20 0.41
ITGA2B P08514 1/20 0.41
AOC3 Q16853 4/20 0.40
ADORA2B P29275 1/20 0.40
RXFP1 Q9HBX9 2/20 0.39
RAB9A P51151 1/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
MEN1 O00255 1/20 0.37
POLB P06746 1/20 0.37
KMT2A Q03164 1/20 0.37
HPGD P15428 4/20 0.36
MAPT P10636 1/20 0.35
PTPN1 P18031 2/20 0.34
KDM4E B2RXH2 2/20 0.34
ALDH1A1 P00352 2/20 0.34
GAA P10253 2/20 0.34
CASP1 P29466 2/20 0.34
HSD17B10 Q99714 2/20 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.

Compoundsimilaritytop predictedshared targets
SCHEMBL2009937 0.96 ITGB3 (0.42) ITGB3ITGA2BAOC3ADORA2BMEN1
SCHEMBL3603113 0.95 ITGB3 (0.42) ITGB3ITGA2BAOC3ADORA2BMEN1
SCHEMBL2008797 0.93 ITGB3 (0.40) ITGB3ITGA2BAOC3ADORA2BL3MBTL1
SCHEMBL3606023 0.90 HPGD (0.45) ITGB3ITGA2BAOC3ADORA2BMEN1
SCHEMBL2013750 0.89 ITGB3 (0.41) ITGB3ITGA2BAOC3ADORA2BRXFP1
SCHEMBL3611645 0.89 ITGB3 (0.42) ITGB3ITGA2BAOC3ADORA2BMEN1
SCHEMBL2008897 0.88 ITGB3 (0.43) ITGB3ITGA2BAOC3RAB9AL3MBTL1
SCHEMBL2009941 0.88 ITGB3 (0.38) ITGB3ITGA2BAOC3ADORA2BMEN1
SCHEMBL2010952 0.87 AOC3 (0.43) ITGB3ITGA2BAOC3ADORA2BRXFP1
SCHEMBL2009674 0.86 ITGB3 (0.51) ITGB3ITGA2BAOC3ADORA2BHPGD

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-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
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 (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 ITGB3 169/4885ITGA2B 63/4885AOC3 3283/4885
US-20070021489-A1 Fibrinogen receptor antagonists and their use FGB, F13B, F2 ITGB3 169/4885ITGA2B 63/4885AOC3 3283/4885

“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.