SCHEMBL5128577

SCHEMBL5128577

Cc1cc(S(=O)(=O)N2CCCCC2CCC(=O)N2CCC(O)(c3cccnc3)CC2)c(C)cc1Cl

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
ALDH1A1 P00352 6/20 0.43
POLB P06746 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
LMNA P02545 2/20 0.39
HCRTR1 O43613 1/20 0.39
HCRTR2 O43614 1/20 0.39
BDKRB1 P46663 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
PKM P14618 1/20 0.37

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
Hydrochloric Acid SCHEMBL5125263 0.99 MEN1 (0.43) MEN1KMT2AALDH1A1POLBSMN1; SMN2
SCHEMBL3825618 0.89 MEN1 (0.42) MEN1KMT2AALDH1A1POLBSMN1; SMN2
SCHEMBL702287 0.89 HCRTR1 (0.36) ALDH1A1POLBHCRTR1HCRTR2BDKRB1
SCHEMBL701280 0.88 BDKRB1 (0.40) ALDH1A1POLBHCRTR1HCRTR2BDKRB1
SCHEMBL5123839 0.88 POLB (0.49) MEN1KMT2AALDH1A1POLBSMN1; SMN2
SCHEMBL701428 0.87 HCRTR1 (0.35) ALDH1A1POLBHCRTR1HCRTR2BDKRB1
SCHEMBL5121357 0.87 HCRTR1 (0.39) ALDH1A1HCRTR1HCRTR2BDKRB1
SCHEMBL709415 0.87 BDKRB1 (0.39) ALDH1A1POLBHCRTR1HCRTR2BDKRB1
SCHEMBL3441828 0.87 BDKRB1 (0.36) ALDH1A1POLBHCRTR1HCRTR2BDKRB1
SCHEMBL3441613 0.86 BDKRB1 (0.36) ALDH1A1POLBHCRTR1HCRTR2BDKRB1

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 MEN1 1340/4885KMT2A 2892/4885ALDH1A1 2737/4885

“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.