SCHEMBL6439211

SCHEMBL6439211

COc1ccc(O)c(C=NNc2nc3nonc3nc2Nc2ccccc2)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 9/20 0.54
MEN1 O00255 7/20 0.54
MAPT P10636 5/20 0.54
KDM4E B2RXH2 3/20 0.54
HTT P42858 3/20 0.54
TDP1 Q9NUW8 3/20 0.54
L3MBTL1 Q9Y468 2/20 0.54
LMNA P02545 1/20 0.54
NPSR1 Q6W5P4 1/20 0.54
GAA P10253 4/20 0.51
RAB9A P51151 3/20 0.51
RECQL P46063 2/20 0.51
ADORA2A P29274 1/20 0.46
ALDH1A1 P00352 3/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
ALPL P05186 1/20 0.43
ALPI P09923 1/20 0.43
ALPG P10696 1/20 0.43
MGAM O43451 3/20 0.43
SI P14410 2/20 0.43

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
SCHEMBL6431543 0.92 DDX3X (0.49) KMT2AMEN1MAPTKDM4EHTT
SCHEMBL6432003 0.90 KMT2A (0.45) KMT2AMEN1MAPTKDM4EHTT
SCHEMBL6431997 0.90 KMT2A (0.45) KMT2AMEN1MAPTKDM4EHTT
SCHEMBL6435487 0.90 MAPT (0.45) KMT2AMEN1MAPTKDM4EHTT
SCHEMBL6435496 0.90 MAPT (0.45) KMT2AMEN1MAPTKDM4EHTT
SCHEMBL6417041 0.87 KMT2A (0.43) KMT2AMEN1MAPTKDM4EHTT
SCHEMBL6417039 0.87 KMT2A (0.43) KMT2AMEN1MAPTKDM4EHTT
SCHEMBL6433398 0.85 ADORA2A (0.51) KMT2AMEN1MAPTKDM4EHTT
SCHEMBL6433407 0.85 ADORA2A (0.51) KMT2AMEN1MAPTKDM4EHTT
SCHEMBL6416317 0.85 MAPT (0.45) KMT2AMEN1MAPTKDM4EHTT

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 3 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
WO-2005044270-A1 OXADIAZOLOPYRAZINE DERIVATIVES AS PHARMACEUTICALLY ACTIVE COMPOUNDS 4SC AG (DE) 2005-05-19 WO 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 KMT2A 3640/4885MEN1 4392/4885MAPT 4420/4885

“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.