SCHEMBL1900750

SCHEMBL1900750

CCOc1ccc(C(=O)C(=O)Nc2cc(C(C)(C)C)ccc2OC)c2ccccc12

nearest known ligand 0.69

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 7/20 0.69
SCARB1 Q8WTV0 10/20 0.53
KDM4E B2RXH2 2/20 0.52
MAPT P10636 2/20 0.52
HPGD P15428 2/20 0.52
ALDH1A1 P00352 1/20 0.52
RECQL P46063 1/20 0.52
LMNA P02545 1/20 0.47
TSHR P16473 1/20 0.47
ATM Q13315 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
HSD17B10 Q99714 1/20 0.47
MEN1 O00255 1/20 0.47
HTT P42858 1/20 0.47
KMT2A Q03164 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
SCHEMBL1905020 0.91 MAPK14 (0.67) MAPK14SCARB1KDM4EMAPTHPGD
SCHEMBL1902191 0.89 MAPK14 (0.71) MAPK14SCARB1KDM4EMAPTHPGD
SCHEMBL1902515 0.85 MAPK14 (0.61) MAPK14SCARB1KDM4EMAPTHPGD
SCHEMBL4949131 0.85 MAPK14 (0.61) MAPK14SCARB1KDM4EMAPTHPGD
SCHEMBL12669939 0.83 MAPK14 (0.84) MAPK14SCARB1
SCHEMBL5820136 0.83 SCARB1 (0.77) MAPK14SCARB1
SCHEMBL1600116 0.83 MAPK14 (0.70) MAPK14SCARB1KDM4EMAPTHPGD
SCHEMBL1600560 0.82 MAPK14 (1.00) MAPK14SCARB1
Hydrochloric Acid SCHEMBL1899167 0.81 MAPK14 (0.98) MAPK14SCARB1
SCHEMBL1599798 0.81 MAPK14 (0.86) MAPK14SCARB1

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
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
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 MAPK14 3352/4885SCARB1 922/4885KDM4E 4464/4885

“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.