SCHEMBL19626518

SCHEMBL19626518

COC(=O)c1sc(C)nc1-c1ccc(Cl)c(Cl)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.53
PKM P14618 1/20 0.53
RCE1 Q9Y256 1/20 0.53
NOTUM Q6P988 1/20 0.51
MAPT P10636 3/20 0.47
DHODH Q02127 1/20 0.47
BRAF P15056 3/20 0.46
PDE4A P27815 3/20 0.46
PDE4B Q07343 3/20 0.46
PDE4C Q08493 3/20 0.46
PDE4D Q08499 3/20 0.46
KMO O15229 2/20 0.45
SLC6A3 Q01959 6/20 0.45
SLC6A2 P23975 3/20 0.45
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
SLC6A4 P31645 1/20 0.43
NPC1 O15118 1/20 0.42
CASP3 P42574 1/20 0.42
RAB9A P51151 1/20 0.42

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
SCHEMBL20079703 0.85 KDM4E (0.65) KDM4EPKMRCE1NOTUMMAPT
SCHEMBL6492363 0.85 PTGDR2 (0.55) KDM4EPKMMAPTDHODHNPC1
SCHEMBL19625428 0.83 KDM4E (0.53) KDM4EPKMRCE1NOTUMMAPT
SCHEMBL1398686 0.81 GAA (0.50) KDM4EMAPTNPC1RAB9A
SCHEMBL203775 0.80 ALDH1A1 (0.60) KDM4EPKMMAPTDHODHMEN1
SCHEMBL4719920 0.79 ALDH1A1 (0.52) KDM4EPKMMAPTDHODHSLC6A3
SCHEMBL276196 0.79 NTRK1 (0.57) KDM4EMAPTDHODHMEN1KMT2A
SCHEMBL924935 0.78 KDM4E (0.74) KDM4EPKMRCE1NOTUMMAPT
SCHEMBL16496588 0.77 CDC7 (0.53) KDM4EPKMMAPTMEN1KMT2A
SCHEMBL28033187 0.76 LMNA (0.53) KDM4EMAPTKMOMEN1KMT2A

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-20170334912-A1 Purine Diones As Wnt Pathway Modulators AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2017-11-23 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-20170334912-A1 Purine Diones As Wnt Pathway Modulators WNT1, WNT3A, CTNNB1 KDM4E 3779/4885PKM 1452/4885RCE1 1268/4885

“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.