SCHEMBL4528495

SCHEMBL4528495

CS(=O)(=O)Nc1cccc2ccncc12

nearest known ligand 0.65

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 1/20 0.65
GLO1 Q04760 2/20 0.54
ALOX15 P16050 1/20 0.54
HTT P42858 1/20 0.54
PTGS1 P23219 11/20 0.51
PTGS2 P35354 9/20 0.51
JAK2 O60674 1/20 0.51
JAK1 P23458 1/20 0.51
RORC P51449 1/20 0.48
SLC22A12 Q96S37 1/20 0.48
NR3C1 P04150 1/20 0.46
PGR P06401 1/20 0.46
NR3C2 P08235 1/20 0.46
AR P10275 1/20 0.46
MAPK10 P53779 1/20 0.46

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
SCHEMBL2912624 0.87 KEAP1 (0.65) KEAP1GLO1ALOX15HTTPTGS1
SCHEMBL29826581 0.87 KEAP1 (0.65) KEAP1GLO1ALOX15HTTPTGS1
SCHEMBL21783687 0.81 TNF (0.49) RORC
SCHEMBL17737617 0.80 RECQL (0.69) GLO1SLC22A12
SCHEMBL2124660 0.79 KEAP1 (1.00) KEAP1GLO1ALOX15HTTJAK2
SCHEMBL17737476 0.77 ALOX12 (0.62) GLO1HTT
SCHEMBL27214183 0.77 SLC40A1 (0.66) GLO1HTTRORC
SCHEMBL17737677 0.76 RECQL (0.58) GLO1HTTSLC22A12
SCHEMBL11983469 0.75 TNF (0.46) ALOX15
SCHEMBL11509065 0.74 KEAP1 (0.77) KEAP1GLO1ALOX15HTTJAK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090264425-A1 CHEMICAL COMPOUNDS PFIZER LIMITED 2009-10-22 US disclosed
US-20090264425-A1 CHEMICAL COMPOUNDS PFIZER LIMITED 2009-10-22 US disclosed
US-20090264425-A1 CHEMICAL COMPOUNDS PFIZER LIMITED 2009-10-22 US disclosed
EP-1831157-A2 NONNUCLEOSIDE INHIBITORS OF HIV-1 REVERSE TRANSCRIPTASE Pfizer Limited (GB) 2007-09-12 EP disclosed
WO-2006067587-A2 NONNUCLEOSIDE INHIBITORS OF HIV-1 REVERSE TRANSCRIPTASE PFIZER LIMITED (GB) 2006-06-29 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-20090264425-A1 CHEMICAL COMPOUNDS POLR2E, POLR2A, POLRMT KEAP1 1335/4885GLO1 1663/4885ALOX15 3138/4885

“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.