SCHEMBL5131980

SCHEMBL5131980

O=C(COCC1Cc2ccccc2CN1S(=O)(=O)c1ccc(Cl)cc1Cl)N1CCC(O)(c2ccccc2)CC1

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.43
GRM5 P41594 3/20 0.40
CCR1 P32246 7/20 0.39
POLB P06746 1/20 0.38
HSD11B1 P28845 1/20 0.38
GAA P10253 1/20 0.37
MAPT P10636 1/20 0.36
CHRM4 P08173 1/20 0.36
TRPV4 Q9HBA0 2/20 0.36
TRPM8 Q7Z2W7 1/20 0.35
PKM P14618 2/20 0.35
ALDH1A1 P00352 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL5128701 0.97 CCR1 (0.41) EPHX2GRM5CCR1POLBMAPT
SCHEMBL5126152 0.92 ALDH1A1 (0.44) GRM5CCR1POLBPKMALDH1A1
SCHEMBL5126144 0.92 ALDH1A1 (0.44) GRM5CCR1POLBPKMALDH1A1
Hydrochloric Acid SCHEMBL5129387 0.91 ALDH1A1 (0.44) GRM5CCR1POLBPKMALDH1A1
SCHEMBL5128421 0.89 EPHX2 (0.44) EPHX2GRM5POLBTRPV4TRPM8
SCHEMBL5128012 0.86 BDKRB1 (0.43) EPHX2CCR1POLBHSD11B1GAA
SCHEMBL5121650 0.84 POLB (0.43) POLBMAPTTRPV4SMN1; SMN2
SCHEMBL3813955 0.84 POLB (0.43) POLBMAPTTRPV4SMN1; SMN2
SCHEMBL2571091 0.83 PSEN1 (0.43) GRM5
SCHEMBL3837762 0.83 MEN1 (0.44) EPHX2GRM5CCR1MAPTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080249128-A1 Substituted Sulfonamide Compounds GRUENENTHAL GMBH (DE) 2008-10-09 US claimed
US-8580965-B2 Substituted sulfonamide compounds GRUENENTHAL GMBH (DE) 2013-11-12 US disclosed
US-20080249128-A1 Substituted Sulfonamide Compounds GRUENENTHAL GMBH (DE) 2008-10-09 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-20080249128-A1 Substituted Sulfonamide Compounds BDKRB1, BDKRB2, NPSR1 EPHX2 1287/4885GRM5 994/4885CCR1 598/4885

“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.