SCHEMBL4517316

SCHEMBL4517316

COc1ccccc1N(c1ccccc1OC)S(=O)(=O)c1cc(S(N)(=O)=O)cc2ccccc12

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.41
CA2 P00918 6/20 0.39
CA1 P00915 4/20 0.39
CA9 Q16790 4/20 0.39
CA12 O43570 3/20 0.39
LMNA P02545 2/20 0.37
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37
ALDH1A1 P00352 2/20 0.37
NPSR1 Q6W5P4 1/20 0.37
POLB P06746 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
KDM4E B2RXH2 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
GAA P10253 1/20 0.37
MAPT P10636 1/20 0.37
CYP2C9 P11712 1/20 0.37
ALOX12 P18054 1/20 0.37
MAPK1 P28482 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
SCHEMBL4517757 0.88 ESR1 (0.47) ESR1CA2CA1CA9CA12
SCHEMBL4496657 0.84 CA2 (0.40) ESR1CA2CA1CA9CA12
SCHEMBL4512410 0.82 CA2 (0.41) ESR1CA2CA1CA9CA12
SCHEMBL4500905 0.81 CA2 (0.40) ESR1CA2CA1CA9CA12
SCHEMBL4507406 0.79 CA2 (0.38) ESR1CA2CA1CA9CA12
SCHEMBL4506268 0.78 CA1 (0.44) ESR1CA2CA1CA9CA12
SCHEMBL4496636 0.76 MEN1 (0.36) CA2CA1CA9CA12LMNA
SCHEMBL4509260 0.76 HTT (0.43) CA2CA1CA9CA12LMNA
SCHEMBL4516373 0.76 CYP1A2 (0.41) CA2CA1CA9CA12LMNA
SCHEMBL4509210 0.76 CA1 (0.43) ESR1CA2CA1CA9CA12

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-20090234014-A1 Naphthalene-Disulfonamides Useful for the Treatment of Inflammation BIOLIPOX AB (SE) 2009-09-17 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-20090234014-A1 Naphthalene-Disulfonamides Useful for the Treatment of Inflammation AREG, PRSS12, CXCL8 ESR1 1760/4885CA2 2959/4885CA1 3172/4885

“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.