SCHEMBL12669727

SCHEMBL12669727

CCOC(=O)C(=O)c1ccc(OCCN2CCOCC2)c2ccccc12

nearest known ligand 0.64

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.64
CNR2 P34972 1/20 0.64
MAPK14 Q16539 14/20 0.59
SCARB1 Q8WTV0 2/20 0.51
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
MAPK13 O15264 1/20 0.50
MAPK12 P53778 1/20 0.50
MAPK11 Q15759 1/20 0.50
POLB P06746 1/20 0.49

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
SCHEMBL1599885 0.89 CNR1 (0.67) CNR1CNR2MAPK14SCARB1MAPK13
SCHEMBL12669723 0.87 CNR1 (0.69) CNR1CNR2MAPK14SCARB1MAPK13
SCHEMBL1903515 0.85 CNR1 (0.71) CNR1CNR2MAPK14SCARB1MEN1
SCHEMBL1600223 0.84 CNR1 (0.69) CNR1CNR2MAPK14SCARB1MAPK13
SCHEMBL4953382 0.84 CNR1 (0.69) CNR1CNR2MAPK14SCARB1MAPK13
SCHEMBL2788543 0.82 CNR1 (0.72) CNR1CNR2MAPK14MAPK13MAPK12
SCHEMBL1601067 0.79 MAPK14 (0.79) CNR1CNR2MAPK14SCARB1
SCHEMBL1599555 0.79 MAPK14 (0.74) CNR1CNR2MAPK14SCARB1MAPK13
SCHEMBL12669804 0.78 MAPK14 (0.66) CNR1CNR2MAPK14SCARB1
SCHEMBL12669802 0.78 MAPK14 (0.66) CNR1CNR2MAPK14SCARB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011063076-A1 METHODS OF TREATING HEPATITIS C VIRUS WITH OXOACETAMIDE COMPOUNDS ITHERX PHARMACEUTICALS, INC. (US) 2011-05-26 WO disclosed
US-20110117055-A1 Methods of Treating Hepatitis C Virus with Oxoacetamide Compounds BRS - TUSTIN SAFEGUARD ASSOCIATES II, LLC 2011-05-19 US disclosed
US-20110117055-A1 Methods of Treating Hepatitis C Virus with Oxoacetamide Compounds BRS - TUSTIN SAFEGUARD ASSOCIATES II, LLC 2011-05-19 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 (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-20110117055-A1 Methods of Treating Hepatitis C Virus with Oxoacetamide Compounds OAT, HAVCR2, OTC CNR1 2859/4885CNR2 2585/4885MAPK14 3352/4885

“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.