SCHEMBL1590587

SCHEMBL1590587

CS(=O)(=O)c1ccc(Nc2nc(N3CCOCC3)nc3c2ncn3-c2cscn2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CSNK1D P48730 3/20 0.51
CSNK1E P49674 2/20 0.51
CDK13 Q14004 1/20 0.51
CDK12 Q9NYV4 1/20 0.51
ABL1 P00519 2/20 0.46
FLT3 P36888 5/20 0.45
PTGS2 P35354 1/20 0.43
EGFR P00533 1/20 0.43
ERBB2 P04626 1/20 0.43
MET P08581 1/20 0.43
PDGFRB P09619 1/20 0.43
KIT P10721 1/20 0.43
FGFR1 P11362 1/20 0.43
SRC P12931 1/20 0.43
FLT1 P17948 1/20 0.43
FGFR2 P21802 1/20 0.43
EPHA2 P29317 1/20 0.43
EPHB2 P29323 1/20 0.43
KDR P35968 1/20 0.43
PDGFRA P16234 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
SCHEMBL1591130 0.92 CSNK1D (0.45) CSNK1DCSNK1ECDK13CDK12ABL1
SCHEMBL1590513 0.88 CSNK1D (0.41) CSNK1DCSNK1ECDK13CDK12ABL1
SCHEMBL1590813 0.88 CSNK1D (0.41) CSNK1DCSNK1ECDK13CDK12ABL1
SCHEMBL1590512 0.88 CSNK1D (0.41) CSNK1DCSNK1ECDK13CDK12ABL1
SCHEMBL3590041 0.88 CSNK1D (0.41) CSNK1DCSNK1ECDK13CDK12ABL1
SCHEMBL1590726 0.86 CSNK1D (0.38) CSNK1DCSNK1ECDK13CDK12ABL1
SCHEMBL1591506 0.81 CSNK1D (0.41) CSNK1DCSNK1ECDK13CDK12ABL1
SCHEMBL1591535 0.81 EGFR (0.41) CSNK1DCSNK1ECDK13CDK12ABL1
SCHEMBL1591536 0.81 EGFR (0.41) CSNK1DCSNK1ECDK13CDK12ABL1
SCHEMBL1591791 0.80 CSNK1D (0.48) CSNK1DCSNK1ECDK13CDK12ABL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110092491-A1 Compounds and Compositions as Inhibitors of Receptor Tyrosine Kinase Activity NOVARTIS AG (CH) 2011-04-21 US disclosed
US-20050124637-A1 Compounds and compositions as inhibitors of receptor tyrosine kinase activity IRM LLC (BM) 2005-06-09 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 (2 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-20050124637-A1 Compounds and compositions as inhibitors of receptor tyrosine kinase activity BMX, LCK, FYN CSNK1D 812/4885CSNK1E 500/4885CDK13 1128/4885
US-20110092491-A1 Compounds and Compositions as Inhibitors of Receptor Tyrosine Kinase Activity BMX, LCK, FYN CSNK1D 812/4885CSNK1E 500/4885CDK13 1128/4885

“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.