SCHEMBL2173841

SCHEMBL2173841

Cc1ccc(S(=O)(=O)N(CC(=O)NCc2cccc(O[C@H](C)C(=O)O)c2)c2cccc(Br)c2C)cc1

nearest known ligand 0.61

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PTGER1 P34995 10/20 0.61
THRB P10828 1/20 0.47
KEAP1 Q14145 2/20 0.47
NFE2L2 Q16236 2/20 0.47
CNR2 P34972 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
ALDH1A1 P00352 1/20 0.46
LMNA P02545 1/20 0.46
HPGD P15428 1/20 0.46
HTT P42858 1/20 0.46
RORC P51449 1/20 0.45
TP53 P04637 1/20 0.45
MAPT P10636 1/20 0.45

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
SCHEMBL12482137 0.92 PTGER1 (0.63) PTGER1THRBCNR2SMN1; SMN2ALDH1A1
SCHEMBL2176725 0.90 PTGER1 (0.61) PTGER1THRBKEAP1NFE2L2CNR2
SCHEMBL2174629 0.90 PTGER1 (0.61) PTGER1THRBKEAP1NFE2L2CNR2
SCHEMBL2175993 0.87 PTGER1 (0.61) PTGER1THRBKEAP1NFE2L2CNR2
SCHEMBL2176263 0.85 PTGER1 (0.63) PTGER1THRBKEAP1NFE2L2CNR2
SCHEMBL2174802 0.85 PTGER1 (0.54) PTGER1THRBLMNA
SCHEMBL2175677 0.84 PTGER1 (0.58) PTGER1THRBSMN1; SMN2ALDH1A1LMNA
SCHEMBL2173163 0.84 PTGER1 (0.57) PTGER1THRBLMNA
SCHEMBL12484727 0.84 PTGER1 (0.65) PTGER1CNR2LMNATP53
SCHEMBL12487408 0.82 PTGER1 (0.57) PTGER1THRBCNR2SMN1; SMN2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7973078-B2 Sulfonamide compound or salt thereof ASTELLAS PHARMA INC. (JP) 2011-07-05 US claimed
US-7973078-B2 Sulfonamide compound or salt thereof ASTELLAS PHARMA INC. (JP) 2011-07-05 US disclosed
US-20090312328-A1 SULFONAMIDE COMPOUND OR SALT THEREOF ASTELLAS PHARMA INC. (JP) 2009-12-17 US disclosed
EP-2050446-A1 SULFONAMIDE COMPOUND OR SALT THEREOF Astellas Pharma Inc. (JP) 2009-04-22 EP 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-20090312328-A1 SULFONAMIDE COMPOUND OR SALT THEREOF PTGER1, CYSLTR1, PTGER2 PTGER1 1/4885THRB 2988/4885KEAP1 835/4885

“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.