SCHEMBL3762706

SCHEMBL3762706

CS(=O)(=O)c1cccc(Nc2nccc(-c3c(-c4ccc(OCc5ccccc5)cc4)nc4ccccn34)n2)c1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK19 Q9BWU1 2/20 0.63
ALK Q9UM73 2/20 0.63
BRAF P15056 2/20 0.53
AURKA O14965 1/20 0.48
MAP4K4 O95819 1/20 0.48
ABL1 P00519 1/20 0.48
LCK P06239 1/20 0.48
MET P08581 1/20 0.48
PDGFRB P09619 1/20 0.48
FGFR1 P11362 1/20 0.48
FLT1 P17948 1/20 0.48
KDR P35968 1/20 0.48
FLT3 P36888 1/20 0.48
MAPK8 P45983 1/20 0.48
MAPK9 P45984 1/20 0.48
GSK3A P49840 1/20 0.48
GSK3B P49841 1/20 0.48
CDK9 P50750 1/20 0.48
CDK5 Q00535 1/20 0.48
ACVR1 Q04771 1/20 0.48

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
SCHEMBL3758735 0.92 CDK19 (0.65) CDK19ALKBRAFCDK2CDK4
SCHEMBL3719752 0.91 CDK19 (0.57) CDK19ALKBRAFCDK2CDK4
SCHEMBL3716771 0.88 CDK19 (0.66) CDK19ALKBRAFCDK2CDK4
SCHEMBL3767568 0.87 CDK19 (0.51) CDK19ALKBRAFAURKAMAP4K4
SCHEMBL3716630 0.85 CDK19 (0.87) CDK19ALKCDK2CDK4CCNE1
SCHEMBL3760452 0.83 CDK19 (0.65) CDK19ALKBRAFMAP4K4ABL1
SCHEMBL3725893 0.82 CDK19 (0.59) CDK19ALKMAP4K4FGFR1KDR
SCHEMBL3763941 0.82 BRAF (0.51) CDK19ALKBRAFAURKAMAP4K4
SCHEMBL3760388 0.81 CDK19 (0.58) CDK19ALKBRAFCDK2CDK4
SCHEMBL3766684 0.81 CDK19 (0.82) CDK19ALKCDK2CDK4CCNE1

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2435436-B1 PYRIMIDINE INHIBITORS OF KINASE ACTIVITY ABBVIE INC (US) 2014-07-30 EP claimed
US-8354422-B2 Pyrimidine inhibitors of kinase activity ABBOTT LABORATORIES INC. (US) 2013-01-15 US claimed
WO-2010138576-A1 PYRIMIDINE INHIBITORS OF KINASE ACTIVITY ABBOTT LABORATORIES (US) 2010-12-02 WO claimed
US-20100305126-A1 Pyrimidine Inhibitors of Kinase Activity ABBOTT LABORATORIES (US) 2010-12-02 US claimed
EP-2435436-B1 PYRIMIDINE INHIBITORS OF KINASE ACTIVITY ABBVIE INC (US) 2014-07-30 EP disclosed
US-8354422-B2 Pyrimidine inhibitors of kinase activity ABBOTT LABORATORIES INC. (US) 2013-01-15 US disclosed
WO-2010138576-A1 PYRIMIDINE INHIBITORS OF KINASE ACTIVITY ABBOTT LABORATORIES (US) 2010-12-02 WO disclosed
US-20100305126-A1 Pyrimidine Inhibitors of Kinase Activity ABBOTT LABORATORIES (US) 2010-12-02 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-20100305126-A1 Pyrimidine Inhibitors of Kinase Activity IGF1R, CDK2, TK1 CDK19 53/4885ALK 534/4885BRAF 283/4885

“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.