SCHEMBL4687630

SCHEMBL4687630

COc1cccc2c1NC(=O)NS2(=O)=O

nearest known ligand 0.64

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CA12 O43570 15/20 0.64
CA1 P00915 15/20 0.64
CA2 P00918 15/20 0.64
CA4 P22748 15/20 0.64
CA7 P43166 15/20 0.64
CA9 Q16790 15/20 0.64
ALPL P05186 1/20 0.44
ALPI P09923 1/20 0.44
SLC40A1 Q9NP59 3/20 0.39

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
SCHEMBL4648066 0.75 CA12 (0.49) CA12CA1CA2CA4CA7
SCHEMBL9278777 0.75 CA12 (1.00) CA12CA1CA2CA4CA7
SCHEMBL18125263 0.75 CA12 (1.00) CA12CA1CA2CA4CA7
SCHEMBL4128481 0.73 RET (0.57) CA12CA1CA2CA4CA7
SCHEMBL4691064 0.71 CA12 (0.44) CA12CA1CA2CA4CA7
SCHEMBL10636828 0.70 CA12 (0.62) CA12CA1CA2CA4CA7
SCHEMBL8286607 0.70 CA12 (0.53) CA12CA1CA2CA9
SCHEMBL29766441 0.67 CA12 (1.00) CA12CA1CA2CA4CA7
SCHEMBL3493374 0.67 CA12 (1.00) CA12CA1CA2CA4CA7
SCHEMBL18953724 0.67 CREBBP (0.39) CA12CA1CA2CA4CA7

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
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 3361/4885CA1 3382/4885CA2 3402/4885

“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.