SCHEMBL6414113

SCHEMBL6414113

CC(C)(C)OC(=O)NNc1nc2nonc2nc1Nc1ccc(F)c(Cl)c1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
EGFR P00533 10/20 0.49
AURKB Q96GD4 1/20 0.49
SMN1; SMN2 Q16637 6/20 0.45
MAPT P10636 5/20 0.45
TP53 P04637 3/20 0.45
CCR2 P41597 1/20 0.45
CCR5 P51681 1/20 0.45
HTT P42858 2/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
POLB P06746 1/20 0.43
ALDH1A1 P00352 1/20 0.43
SYK P43405 1/20 0.39
FBP1 P09467 1/20 0.39
KDR P35968 1/20 0.39
ERBB2 P04626 1/20 0.38

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
SCHEMBL6416982 0.91 MAPT (0.45) EGFRAURKBSMN1; SMN2MAPTTP53
SCHEMBL6416313 0.86 MAPT (0.47) EGFRSMN1; SMN2MAPTTP53CCR2
SCHEMBL6419799 0.85 SMN1; SMN2 (0.48) SMN1; SMN2MAPTTP53CCR2CCR5
SCHEMBL6419677 0.81 GAA (0.49) SMN1; SMN2MAPTTP53CCR2CCR5
SCHEMBL15559868 0.79 HTT (0.52) EGFRAURKBSMN1; SMN2MAPTHTT
SCHEMBL3054066 0.74 MAPT (0.43) EGFRAURKBSMN1; SMN2MAPTTP53
SCHEMBL6416881 0.74 MAPT (0.51) EGFRSMN1; SMN2MAPTTP53CCR2
SCHEMBL6416039 0.74 MEN1 (0.44) SMN1; SMN2MAPTTP53HTTMEN1
SCHEMBL3060981 0.73 MAPT (0.44) EGFRAURKBSMN1; SMN2MAPTTP53
Hydrochloric Acid SCHEMBL6413527 0.73 MAPT (0.50) EGFRSMN1; SMN2MAPTTP53CCR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050143382-A1 Heterocyclic compounds as pharmaceutically active compounds 4SC AG (DE) 2005-06-30 US disclosed
EP-1529531-A1 Oxadiazolopyrazine derivatives as pharmaceutically active compounds 4SC AG (DE) 2005-05-11 EP 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-20050143382-A1 Heterocyclic compounds as pharmaceutically active compounds NR5A2, NR1H2, NR2C2 EGFR 1083/4885AURKB 1529/4885SMN1; SMN2 4369/4885

“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.