SCHEMBL12138596

SCHEMBL12138596

CNC(=O)Nc1ccc2[nH]c(=O)[nH]c2c1

nearest known ligand 0.69

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.69
GAA P10253 1/20 0.69
MAPT P10636 13/20 0.61
KMT2A Q03164 3/20 0.61
MEN1 O00255 2/20 0.61
APEX1 P27695 1/20 0.61
MAPK1 P28482 1/20 0.60
ALDH1A1 P00352 10/20 0.58
KLK7 P49862 1/20 0.57
L3MBTL1 Q9Y468 1/20 0.57
HTT P42858 1/20 0.56
RAB9A P51151 1/20 0.56
XDH P47989 1/20 0.55
LMNA P02545 1/20 0.54

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
SCHEMBL20775957 0.84 KMT2A (0.67) KDM4EGAAMAPTKMT2AMEN1
SCHEMBL22424928 0.84 MAPT (0.76) KDM4EGAAMAPTKMT2AMEN1
SCHEMBL6740302 0.83 MEN1 (0.69) KDM4EGAAMAPTKMT2AMEN1
SCHEMBL22425088 0.83 ALDH1A1 (0.76) KDM4EGAAMAPTKMT2AMEN1
SCHEMBL22424899 0.82 MAPT (0.68) KDM4EGAAMAPTKMT2AMEN1
SCHEMBL20777328 0.82 MAPT (0.75) KDM4EGAAMAPTKMT2AMEN1
SCHEMBL22424896 0.81 MAPT (0.66) KDM4EGAAMAPTKMT2AMEN1
SCHEMBL22424884 0.81 MAPT (0.62) KDM4EGAAMAPTKMT2AMEN1
SCHEMBL22425073 0.81 MAPT (0.66) KDM4EGAAMAPTKMT2AMEN1
SCHEMBL22425346 0.81 MAPT (0.76) KDM4EGAAMAPTKMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110282072-A1 SELF-ASSEMBLED NANOSTRUCTURES NATIONAL RESEARCH COUNCIL OF CANADA (CA) 2011-11-17 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-20110282072-A1 SELF-ASSEMBLED NANOSTRUCTURES RB1, CNKSR1, RBBP4 KDM4E 1092/4885GAA 3349/4885MAPT 3230/4885

“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.