SCHEMBL1640319

SCHEMBL1640319

CN(C)CCOc1cccc(Nc2nccc(-c3scnc3-c3cccc(NC(=O)Cc4cccs4)c3)n2)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 10/20 0.49
EGFR P00533 3/20 0.49
ERBB2 P04626 3/20 0.49
PTK2 Q05397 1/20 0.49
CDK19 Q9BWU1 1/20 0.49
MEN1 O00255 3/20 0.45
KMT2A Q03164 3/20 0.45
HPGD P15428 2/20 0.45
IKBKB O14920 1/20 0.45
INSR P06213 1/20 0.43
ABL1 P00519 2/20 0.42
PRKD3 O94806 1/20 0.42
MAP4K4 O95819 1/20 0.42
PAK4 O96013 1/20 0.42
LCK P06239 1/20 0.42
FYN P06241 1/20 0.42
CSF1R P07333 1/20 0.42
RET P07949 1/20 0.42
MET P08581 1/20 0.42
ROS1 P08922 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
SCHEMBL1641883 0.93 AGER (0.45) IGF1REGFRERBB2PTK2CDK19
SCHEMBL1641894 0.90 IGF1R (0.47) IGF1REGFRERBB2PTK2CDK19
SCHEMBL12726553 0.88 IGF1R (0.54) IGF1REGFRERBB2PTK2CDK19
SCHEMBL13816025 0.85 IGF1R (0.41) IGF1REGFRERBB2PTK2CDK19
SCHEMBL1786167 0.85 IGF1R (0.67) IGF1REGFRERBB2PTK2CDK19
SCHEMBL12766485 0.84 IGF1R (0.56) IGF1REGFRERBB2INSRPRKD3
SCHEMBL3540612 0.84 SLC2A1 (0.53) IGF1REGFRERBB2PTK2CDK19
SCHEMBL3539635 0.83 IGF1R (0.47) IGF1REGFRERBB2PTK2CDK19
SCHEMBL3541069 0.83 IGF1R (0.46) IGF1REGFRERBB2PTK2CDK19
SCHEMBL3546594 0.83 IGF1R (0.52) IGF1REGFRERBB2PTK2CDK19

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-20110098296-A1 Thiazole And Oxazole Kinase Inhibitors GLAXOSMITHKLINE LLC 2011-04-28 US disclosed
US-20110098296-A1 Thiazole And Oxazole Kinase Inhibitors GLAXOSMITHKLINE LLC 2011-04-28 US disclosed
US-20110098296-A1 Thiazole And Oxazole Kinase Inhibitors GLAXOSMITHKLINE LLC 2011-04-28 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-20110098296-A1 Thiazole And Oxazole Kinase Inhibitors PDXK, MAP3K1, MAP4K2 IGF1R 396/4885EGFR 478/4885ERBB2 69/4885

“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.