SCHEMBL5578089

SCHEMBL5578089

CC(C)(C)OC(=O)COc1ccc(-c2cncn2-c2n[nH]c3nc(NC(=O)C4CC4)sc23)c(Cl)c1

nearest known ligand 0.36

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CLK1 P49759 1/20 0.36
ABL1 P00519 5/20 0.35
KMT2A Q03164 3/20 0.35
MEN1 O00255 2/20 0.35
JAK1 P23458 1/20 0.35
MAPK1 P28482 2/20 0.35
KDM4E B2RXH2 1/20 0.35
ALDH1A1 P00352 1/20 0.35
MAPT P10636 1/20 0.35
HPGD P15428 1/20 0.35
HSD17B10 Q99714 1/20 0.35
WNT1 P04628 3/20 0.34
GSK3B P49841 3/20 0.34
DYRK1A Q13627 3/20 0.34
BRAF P15056 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
HDAC8 Q9BY41 1/20 0.33
CHKA P35790 1/20 0.33
CHKB Q9Y259 1/20 0.33

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
SCHEMBL5578159 0.90 MEN1 (0.38) CLK1ABL1KMT2AMEN1JAK1
SCHEMBL14454892 0.90 MEN1 (0.38) CLK1ABL1KMT2AMEN1JAK1
SCHEMBL14454904 0.89 CLK1 (0.37) CLK1ABL1KMT2AMEN1JAK1
SCHEMBL14454919 0.89 PDK2 (0.36) CLK1ABL1KMT2AMEN1JAK1
SCHEMBL14454902 0.89 CLK1 (0.38) CLK1ABL1KMT2AMEN1JAK1
SCHEMBL14454901 0.88 CLK1 (0.39) CLK1ABL1KMT2AMEN1JAK1
SCHEMBL14454890 0.88 KMT2A (0.42) CLK1ABL1KMT2AMEN1MAPK1
SCHEMBL14454970 0.87 ABL1 (0.37) CLK1ABL1KMT2AMEN1JAK1
SCHEMBL14454930 0.87 CLK1 (0.37) CLK1ABL1KMT2AMEN1JAK1
SCHEMBL14454934 0.86 MEN1 (0.36) CLK1ABL1KMT2AMEN1JAK1

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-20070173488-A1 Pyrazolothiazole Protein Kinase Modulators SGX PHARMACEUTICALS, INC. (US) 2007-07-26 US disclosed
US-20070173488-A1 Pyrazolothiazole Protein Kinase Modulators SGX PHARMACEUTICALS, INC. (US) 2007-07-26 US disclosed
WO-2007059341-A2 PYRAZOLOTHIAZOLE PROTEIN KINASE MODULATORS SGX PHARMACEUTICALS, INC. (US) 2007-05-24 WO 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-20070173488-A1 Pyrazolothiazole Protein Kinase Modulators MAP4K2, MAP4K5, MAP4K3 CLK1 313/4885ABL1 246/4885KMT2A 1434/4885

“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.