SCHEMBL5378696

SCHEMBL5378696

O=S(=O)(Br)Nc1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 4/20 0.58
KEAP1 Q14145 3/20 0.58
CA1 P00915 3/20 0.58
IL1RN P18510 1/20 0.56
ERAP1 Q9NZ08 1/20 0.56
KMT2A Q03164 4/20 0.52
MEN1 O00255 3/20 0.52
PKM P14618 2/20 0.52
ALDH1A1 P00352 2/20 0.52
CA12 O43570 4/20 0.47
CA9 Q16790 4/20 0.47
PGR P06401 2/20 0.42
POLB P06746 1/20 0.42
GAA P10253 1/20 0.41
MAPT P10636 1/20 0.41
MAPK1 P28482 1/20 0.41
HTT P42858 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
CTSD P07339 1/20 0.41
TDP1 Q9NUW8 1/20 0.41

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
SCHEMBL59151 0.78 KEAP1 (0.64) CA2KEAP1CA1IL1RNERAP1
SCHEMBL6005110 0.78 CA2 (0.64) CA2KEAP1CA1IL1RNERAP1
SCHEMBL23141160 0.76 KEAP1 (0.61) CA2KEAP1CA1IL1RNERAP1
SCHEMBL14571964 0.75 CA2 (0.54) CA2KEAP1CA1IL1RNERAP1
SCHEMBL14571958 0.75 KEAP1 (0.54) CA2KEAP1CA1IL1RNERAP1
SCHEMBL28590445 0.75 CA2 (0.54) CA2KEAP1CA1IL1RNERAP1
SCHEMBL1621848 0.75 CA1 (0.35) CA2KEAP1CA1IL1RNERAP1
SCHEMBL146561 0.74 CA2 (0.58) CA2KEAP1CA1IL1RNERAP1
Benzene SCHEMBL6746153 0.74 CA2 (0.58) CA2KEAP1CA1IL1RNERAP1
SCHEMBL593259 0.74 KEAP1 (0.58) CA2KEAP1CA1IL1RNERAP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7262318-B2 Substituted heteroaryl- and phenylsulfamoyl compounds PFIZER, INC. (US) 2007-08-28 US disclosed
CN-1930121-A Substituted heteroaryl- and phenylsulfamoyl compounds PFIZER PROD INC (US) 2007-03-14 CN disclosed
EP-1725524-A1 SUBSTITUTED HETEROARYL- AND PHENYLSULFAMOYL COMPOUNDS Pfizer Products Incorporated (US) 2006-11-29 EP disclosed
US-20060258723-A1 Substituted Heteroaryl- and Phenylsulfamoyl Compounds PFIZER INC 2006-11-16 US disclosed
US-20050228015-A1 Substituted heteroaryl- and phenylsulfamoyl compounds PFIZER INC 2005-10-13 US disclosed
WO-2005092845-A1 SUBSTITUTED HETEROARYL- AND PHENYLSULFAMOYL COMPOUNDS PFIZER PRODUCTS INC. (US) 2005-10-06 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 (2 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-20050228015-A1 Substituted heteroaryl- and phenylsulfamoyl compounds PPARA, PPARG, PPARD CA2 4864/4885KEAP1 810/4885CA1 4881/4885
US-20060258723-A1 Substituted Heteroaryl- and Phenylsulfamoyl Compounds PPARG, PPARA, PPARD CA2 4852/4885KEAP1 1215/4885CA1 4879/4885

“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.