SCHEMBL5121906

SCHEMBL5121906

O=C(COCC1CCCCN1S(=O)(=O)c1ccc(Cl)c(Cl)c1)N1CCC(O)(c2cccnc2)CC1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.47
ALDH1A1 P00352 3/20 0.47
CASP3 P42574 4/20 0.43
CASP7 P55210 4/20 0.43
TSHR P16473 2/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
FKBP1A P62942 1/20 0.41
FKBP4 Q02790 1/20 0.41
FKBP5 Q13451 1/20 0.41
NAMPT P43490 4/20 0.41
RECQL P46063 1/20 0.40
CASP6 P55212 1/20 0.39

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
SCHEMBL5131574 0.98 LMNA (0.49) LMNAALDH1A1CASP3CASP7TSHR
SCHEMBL3825000 0.94 ALDH1A1 (0.45) LMNAALDH1A1CASP3CASP7MEN1
SCHEMBL5121787 0.88 ALDH1A1 (0.47) LMNAALDH1A1MEN1KMT2AFKBP1A
SCHEMBL5127710 0.86 BRD4 (0.44) ALDH1A1CASP3CASP7MEN1KMT2A
SCHEMBL3823563 0.86 ALDH1A1 (0.46) LMNAALDH1A1CASP3CASP7MEN1
SCHEMBL3825150 0.86 ALDH1A1 (0.47) LMNAALDH1A1CASP3CASP7MEN1
SCHEMBL5131871 0.86 ALDH1A1 (0.45) LMNAALDH1A1MEN1KMT2ANAMPT
SCHEMBL3825618 0.86 MEN1 (0.42) LMNAALDH1A1MEN1KMT2AFKBP1A
SCHEMBL5132569 0.85 RECQL (0.44) LMNAALDH1A1CASP3CASP7TSHR
SCHEMBL5127744 0.85 MEN1 (0.42) LMNAALDH1A1CASP3CASP7MEN1

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-8580965-B2 Substituted sulfonamide compounds GRUENENTHAL GMBH (DE) 2013-11-12 US claimed
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 LMNA 1324/4885ALDH1A1 2737/4885CASP3 2844/4885

“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.