SCHEMBL6508306

SCHEMBL6508306

NC(=O)Nc1cn(-c2ccc(S(N)(=O)=O)cc2)nc1C(N)=O

nearest known ligand 0.54

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CA9 Q16790 20/20 0.54
CA12 O43570 19/20 0.54
CA1 P00915 13/20 0.54
CA2 P00918 13/20 0.54

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
SCHEMBL6500903 0.85 IRAK4 (0.41) CA9CA12CA1CA2
SCHEMBL6468270 0.85 CA9 (0.48) CA9CA12CA1CA2
SCHEMBL6505306 0.85 CA12 (0.42) CA9CA12CA1CA2
SCHEMBL6466511 0.82 ITK (0.44)
SCHEMBL6467527 0.82 KDM4E (0.47) CA9CA12CA1CA2
SCHEMBL6465833 0.82 ALDH1A1 (0.53) CA9CA12CA1CA2
SCHEMBL6469788 0.82 KMT2A (0.46) CA9CA12CA1CA2
SCHEMBL6469794 0.82 LMNA (0.47) CA9CA12CA1CA2
SCHEMBL6506662 0.82 IRAK4 (0.40) CA9CA12CA1CA2
SCHEMBL6467588 0.81 ABCC9 (0.42) CA9CA12CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050197338-A1 Substituted pyrazole urea compounds for the treatment of inflammation PHARMACIA AND UPJOHN COMPANY LLC 2005-09-08 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-20050197338-A1 Substituted pyrazole urea compounds for the treatment of inflammation IL4, ARG2, CASP4 CA9 4345/4885CA12 3831/4885CA1 3159/4885

“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.