SCHEMBL4648066

SCHEMBL4648066

COc1cc(Cl)cc2c1NC(=O)NS2(=O)=O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 15/20 0.49
CA2 P00918 15/20 0.49
CA4 P22748 15/20 0.49
CA7 P43166 15/20 0.49
CA9 Q16790 15/20 0.49
CA1 P00915 14/20 0.49
CHEK1 O14757 1/20 0.37
DAPK3 O43293 1/20 0.37
MAP4K4 O95819 1/20 0.37
RET P07949 1/20 0.37
PIM1 P11309 1/20 0.37
LTK P29376 1/20 0.37
GRK5 P34947 1/20 0.37
CSNK1A1 P48729 1/20 0.37
CDK8 P49336 1/20 0.37
PRKX P51817 1/20 0.37
LIMK1 P53667 1/20 0.37
CDK5 Q00535 1/20 0.37
ACVR1 Q04771 1/20 0.37
PTK2 Q05397 1/20 0.37

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
SCHEMBL4691064 0.77 CA12 (0.44) CA12CA2CA4CA7CA9
SCHEMBL10636828 0.71 CA12 (0.62) CA12CA2CA4CA7CA9
SCHEMBL4686117 0.69 SERPINH1 (0.35) MAP4K4PIM1CDK5DYRK1ACLK4
SCHEMBL8492205 0.66 CA12 (1.00) CA12CA2CA4CA7CA9
SCHEMBL7954369 0.65 CA12 (0.80) CA12CA2CA4CA7CA9
SCHEMBL8494657 0.65 CA12 (0.97) CA12CA2CA4CA7CA9
SCHEMBL3760039 0.62 CA12 (1.00) CA12CA2CA4CA7CA9
SCHEMBL18953367 0.61 SERPINH1 (0.34) CLK4
SCHEMBL7290897 0.60 ALDH1A1 (0.46) CA12CA2CA4CA7CA9
SCHEMBL12261815 0.60 RET (0.51) CA12CA2CA4CA7CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060122173-A1 Il-8 receptor antagonists BUSCH-PETERSEN JAKOB 2006-06-08 US claimed
EP-1631559-A4 IL-8 RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORP (US) 2008-08-27 EP disclosed
US-20060122173-A1 Il-8 receptor antagonists BUSCH-PETERSEN JAKOB 2006-06-08 US disclosed
EP-1631559-A2 IL-8 RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 2006-03-08 EP disclosed
WO-2005000231-A2 IL-8 RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 2005-01-06 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-20060122173-A1 Il-8 receptor antagonists CXCL8, CCR8, IL1RN CA12 3361/4885CA2 3402/4885CA4 3712/4885

“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.