SCHEMBL6418400

SCHEMBL6418400

O=S(=O)(O)c1ccc(C=NNc2nc3nonc3nc2NCc2ccccc2)o1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 3/20 0.49
CA2 P00918 2/20 0.41
BIRC5 O15392 1/20 0.40
KDM4E B2RXH2 5/20 0.36
MEN1 O00255 4/20 0.36
KMT2A Q03164 4/20 0.36
THRB P10828 1/20 0.36
MAPT P10636 6/20 0.35
LMNA P02545 3/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
MAPK1 P28482 2/20 0.35
HTT P42858 2/20 0.35
BLM P54132 1/20 0.35
MYC P01106 1/20 0.34
ALDH1A1 P00352 4/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
TLR9 Q9NR96 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
DDX3X O00571 1/20 0.34

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
SCHEMBL6510185 0.82 BIRC5 (0.50) BIRC5KDM4EMEN1KMT2ATHRB
SCHEMBL6419253 0.79 PHGDH (0.57) BIRC5KDM4EMEN1KMT2AMAPT
SCHEMBL6419258 0.79 PHGDH (0.57) BIRC5KDM4EMEN1KMT2AMAPT
SCHEMBL6416985 0.78 MAPT (0.51) KDM4EMEN1KMT2AMAPTLMNA
SCHEMBL6416975 0.78 MAPT (0.51) KDM4EMEN1KMT2AMAPTLMNA
SCHEMBL6414142 0.78 MAPT (0.43) KDM4EMEN1KMT2AMAPTLMNA
SCHEMBL6421076 0.78 MAPT (0.50) CA1CA2BIRC5KDM4EMEN1
SCHEMBL6421081 0.78 MAPT (0.50) CA1CA2BIRC5KDM4EMEN1
SCHEMBL6414195 0.78 MAPT (0.40) BIRC5KDM4EMEN1KMT2AMAPT
SCHEMBL6414183 0.78 MAPT (0.40) BIRC5KDM4EMEN1KMT2AMAPT

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 CA1 4415/4885CA2 3781/4885BIRC5 2525/4885

“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.