SCHEMBL6414619

SCHEMBL6414619

CC(C)(C)OC(=O)NNc1nc2nonc2nc1NCc1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.46
KMT2A Q03164 4/20 0.46
GAA P10253 3/20 0.46
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44
CA7 P43166 1/20 0.44
CA14 Q9ULX7 1/20 0.44
SLC26A6 Q9BXS9 2/20 0.43
ATM Q13315 1/20 0.41
AKT1 P31749 2/20 0.40
SMN1; SMN2 Q16637 3/20 0.39
CCNE2 O96020 1/20 0.39
CCNA2 P20248 1/20 0.39
CCNE1 P24864 1/20 0.39
CDK2 P24941 1/20 0.39
CCNA1 P78396 1/20 0.39
KDM4E B2RXH2 2/20 0.39
LMNA P02545 1/20 0.39

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
SCHEMBL6419677 0.83 GAA (0.49) MEN1KMT2AGAANPC1RAB9A
SCHEMBL6416039 0.78 MEN1 (0.44) MEN1KMT2AGAANPC1RAB9A
SCHEMBL26034950 0.78 KMT2A (0.58) MEN1KMT2ARAB9AATMSMN1; SMN2
SCHEMBL6436341 0.78 MAPK1 (0.42) MEN1KMT2AGAACA12CA1
SCHEMBL6414172 0.74 GAA (0.40) MEN1KMT2AGAANPC1RAB9A
SCHEMBL6419799 0.74 SMN1; SMN2 (0.48) MEN1KMT2AGAANPC1RAB9A
SCHEMBL6414257 0.73 GAA (0.39) MEN1KMT2AGAANPC1RAB9A
SCHEMBL6416313 0.73 MAPT (0.47) MEN1KMT2AGAANPC1RAB9A
SCHEMBL6416982 0.72 MAPT (0.45) MEN1KMT2AGAANPC1RAB9A
SCHEMBL6415904 0.71 LMNA (0.51) MEN1KMT2AGAAATMSMN1; SMN2

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 MEN1 4392/4885KMT2A 3640/4885GAA 3186/4885

“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.