SCHEMBL3489638

SCHEMBL3489638

O=C1Nc2cc(Cl)cc(Cl)c2S(=O)(=O)N1Cc1ccc(Br)cc1

nearest known ligand 0.45

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.42
CA9 Q16790 1/20 0.42
HTR6 P50406 1/20 0.40
ITGAL P20701 1/20 0.38
HSD11B1 P28845 4/20 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
SCHEMBL3490560 0.91 CA12 (0.43) CA12CA9HSD11B1
SCHEMBL3489975 0.88 CA12 (0.47) CA12CA9
SCHEMBL3490894 0.87 HTR6 (0.40) HTR6HSD11B1
SCHEMBL3490831 0.87 CA12 (0.42) CA12CA9HSD11B1
SCHEMBL3490935 0.87 CA12 (0.42) CA12CA9HSD11B1
SCHEMBL3488658 0.86 CA12 (0.41) CA12CA9
SCHEMBL3490938 0.84 HTR6 (0.44) HTR6
SCHEMBL3491791 0.83 MAPT (0.43) HSD11B1
SCHEMBL3490975 0.80 CA12 (0.47) CA12CA9HSD11B1
SCHEMBL3491529 0.80 HSD11B1 (0.40) HSD11B1

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-20100035866-A1 NOVEL SUBSTITUTED-1, 1-DIOXO-BENZO[1,2,4]THIADIAZIN-3ONES, PREPARATION METHOD THEREOF, AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2010-02-11 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-20100035866-A1 NOVEL SUBSTITUTED-1, 1-DIOXO-BENZO[1,2,4]THIADIAZIN-3ONES, PREPARATION METHOD THEREOF, AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME OPRD1, HTR6, HTR1D CA12 4883/4885CA9 4884/4885HTR6 2/4885

“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.