SCHEMBL6695984

SCHEMBL6695984

Cc1ccc(NC(=O)Nc2ncc(CCNC(=O)NCCN(C)C)s2)c(N2CCCCC2)c1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
GAA P10253 1/20 0.41
POLB P06746 1/20 0.40
MAPK13 O15264 2/20 0.40
MAPK14 Q16539 3/20 0.39
TP53 P04637 2/20 0.39
MAPT P10636 2/20 0.39
CHEK1 O14757 2/20 0.38
ATM Q13315 1/20 0.38
AURKA O14965 2/20 0.37
AURKB Q96GD4 1/20 0.37
PRNP P04156 1/20 0.37
PLK1 P53350 1/20 0.37
NPSR1 Q6W5P4 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36

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
SCHEMBL1341869 0.93 MEN1 (0.41) MEN1KMT2AKDM4EALDH1A1GAA
SCHEMBL2651109 0.90 CHEK1 (0.40) MEN1KMT2AKDM4EALDH1A1GAA
SCHEMBL6693383 0.89 POLB (0.41) MEN1KMT2APOLBMAPK13MAPK14
SCHEMBL1343347 0.89 POLB (0.43) MEN1KMT2APOLBMAPK13MAPK14
SCHEMBL6692117 0.88 POLB (0.42) MEN1KMT2APOLBMAPK13MAPK14
SCHEMBL1340929 0.87 SMN1; SMN2 (0.46) MEN1KMT2APOLBMAPK13MAPK14
SCHEMBL6698888 0.86 POLB (0.41) MEN1KMT2APOLBMAPK13MAPK14
SCHEMBL1344262 0.86 POLB (0.45) MEN1KMT2APOLBMAPK13TP53
SCHEMBL1341067 0.84 POLB (0.42) POLBMAPK13MAPK14TP53MAPT
SCHEMBL1341009 0.83 CHEK1 (0.41) MEN1KMT2AKDM4EALDH1A1GAA

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-20040122235-A1 Aryl carbonyl derivatives as therapeutic agents VTV THERAPEUTICS LLC 2004-06-24 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-20040122235-A1 Aryl carbonyl derivatives as therapeutic agents GCK, GCKR, PDK2 MEN1 4426/4885KMT2A 1526/4885KDM4E 992/4885

“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.