SCHEMBL4510070

SCHEMBL4510070

CCc1ccccc1N(c1ccccc1CC)S(=O)(=O)c1cc(S(N)(=O)=O)cc2ccc(O)cc12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGES O14684 1/20 0.39
ESR1 P03372 6/20 0.37
ESR2 Q92731 1/20 0.37
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
LMNA P02545 2/20 0.34
MCL1 Q07820 1/20 0.34
MPL P40238 1/20 0.34
KMT2A Q03164 3/20 0.33
MTNR1A P48039 2/20 0.33
MTNR1B P49286 2/20 0.33
KDM4E B2RXH2 2/20 0.33
MEN1 O00255 2/20 0.33
NQO2 P16083 2/20 0.33
ALDH1A1 P00352 1/20 0.33
USP2 O75604 1/20 0.33
POLB P06746 1/20 0.33
CASP1 P29466 1/20 0.33
CASP7 P55210 1/20 0.33
HSD17B10 Q99714 1/20 0.33

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
SCHEMBL4511441 0.87 PTGES (0.40) PTGESESR1NPC1RAB9ALMNA
SCHEMBL4505853 0.86 PTGES (0.46) PTGESESR1ESR2NPC1RAB9A
SCHEMBL4503529 0.85 ESR1 (0.41) PTGESESR1NPC1RAB9ALMNA
SCHEMBL4517757 0.83 ESR1 (0.47) PTGESESR1LMNAKMT2AKDM4E
SCHEMBL4497864 0.81 ESR1 (0.42) PTGESESR1NPC1RAB9ALMNA
SCHEMBL4508410 0.81 PTGES (0.41) PTGESESR1NPC1RAB9ALMNA
SCHEMBL4494785 0.81 ESR1 (0.49) PTGESESR1NPC1RAB9ALMNA
SCHEMBL4506540 0.81 PTGES (0.40) PTGESESR1ESR2NPC1RAB9A
SCHEMBL4503637 0.81 PTGES (0.40) PTGESESR1LMNAMCL1KMT2A
SCHEMBL4510732 0.80 PTGES2 (0.41) PTGESESR1ESR2LMNAMCL1

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 PTGES 41/4885ESR1 1760/4885ESR2 793/4885

“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.