SCHEMBL5131244

SCHEMBL5131244

O=C(COCC1CCCN1S(=O)(=O)c1cc(Cl)sc1Cl)N1CCC(O)(c2cccc(C(F)(F)F)c2)CC1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM4 P08173 1/20 0.42
OPRL1 P41146 8/20 0.41
OPRM1 P35372 7/20 0.41
OPRK1 P41145 3/20 0.41
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
OPRD1 P41143 2/20 0.39
S1PR1 P21453 1/20 0.39
SOS1 Q07889 1/20 0.37
PKLR P30613 1/20 0.36
ABCB11 O95342 1/20 0.36
TP53 P04637 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
PKM P14618 1/20 0.36
TSHR P16473 1/20 0.36
MAPK1 P28482 1/20 0.36
THPO P40225 1/20 0.36
MTOR P42345 1/20 0.36
EBP Q15125 1/20 0.36

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
SCHEMBL5129420 0.89 CHRM4 (0.37) CHRM4PKMCASP1CASP3CASP7
SCHEMBL5131952 0.88 OPRM1 (0.44) OPRL1OPRM1OPRK1OPRD1SIGMAR1
SCHEMBL5128309 0.88 CHRM4 (0.45) CHRM4OPRL1OPRM1OPRK1MEN1
SCHEMBL5125564 0.87 CHRM4 (0.45) CHRM4OPRL1OPRM1OPRK1MEN1
SCHEMBL5128726 0.87 PKM (0.36) CHRM4MEN1KMT2APKMCASP1
SCHEMBL5131365 0.86 OPRM1 (0.45) OPRL1OPRM1OPRK1OPRD1SIGMAR1
SCHEMBL5128613 0.86 OPRL1 (0.44) CHRM4OPRL1OPRM1OPRK1MEN1
SCHEMBL5129027 0.86 CCR1 (0.39) MEN1KMT2APKMCASP3CASP7
SCHEMBL3825264 0.85 MEN1 (0.43) MEN1KMT2ACYP3A4CYP2D6PKM
SCHEMBL5126195 0.85 OPRL1 (0.45) CHRM4OPRL1OPRM1OPRK1MEN1

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 CHRM4 891/4885OPRL1 10/4885OPRM1 232/4885

“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.