SCHEMBL1640795

SCHEMBL1640795

Cc1nc(-c2cccc(NC(=O)c3ccc(F)cc3)c2)c(-c2ccnc(Nc3ccc(OCCN(C)C)c(Cl)c3)n2)s1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
EGFR P00533 3/20 0.50
ABL1 P00519 6/20 0.49
BCR P11274 5/20 0.49
PDGFRB P09619 2/20 0.49
PDGFRA P16234 2/20 0.49
KDR P35968 2/20 0.48
CDK7 P50613 1/20 0.47
CCNH P51946 1/20 0.47
IGF1R P08069 5/20 0.47
CDC7 O00311 1/20 0.47
CDK19 Q9BWU1 1/20 0.47
BTK Q06187 1/20 0.45
SLC2A1 P11166 1/20 0.44
MAPK8 P45983 1/20 0.44
MAPK9 P45984 1/20 0.44
MAPK10 P53779 1/20 0.44
ABL2 P42684 1/20 0.44
ERBB2 P04626 1/20 0.44

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
SCHEMBL1640393 0.91 KDR (0.52) EGFRABL1BCRKDRCDK7
SCHEMBL1641862 0.91 KDR (0.52) EGFRABL1BCRPDGFRBPDGFRA
SCHEMBL1641857 0.91 SLC2A1 (0.54) EGFRABL1BCRKDRIGF1R
SCHEMBL1641982 0.86 BRAF (0.51) EGFRKDR
SCHEMBL1640567 0.85 SLC2A1 (0.49) EGFRABL1BCRPDGFRBPDGFRA
SCHEMBL1640704 0.85 SLC2A1 (0.58) EGFRABL1BCRKDRIGF1R
SCHEMBL1642212 0.85 EGFR (0.47) EGFRABL1BCRPDGFRBPDGFRA
SCHEMBL12766944 0.85 IGF1R (0.54) EGFRABL1BCRKDRIGF1R
SCHEMBL1641698 0.84 SLC2A1 (0.53) EGFRABL1BCRKDRIGF1R
SCHEMBL12766445 0.84 SLC2A1 (0.53) EGFRABL1BCRKDRIGF1R

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 4 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
WO-2009076140-A1 THIAZOLE AND OXAZOLE KINASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2009-06-18 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-20110098296-A1 Thiazole And Oxazole Kinase Inhibitors PDXK, MAP3K1, MAP4K2 EGFR 478/4885ABL1 77/4885BCR 1332/4885

“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.