SCHEMBL492882

SCHEMBL492882

CN(COCCC(=O)O)S(=O)(=O)c1c(Cl)cc(Cl)cc1Cl

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
RXRA P19793 5/20 0.37
RXRB P28702 4/20 0.37
RXRG P48443 4/20 0.37
KDM4E B2RXH2 2/20 0.36
TDP1 Q9NUW8 1/20 0.36
MCL1 Q07820 1/20 0.35
ACLY P53396 1/20 0.35
GPR17 Q13304 1/20 0.35
FABP4 P15090 2/20 0.33
SLC9A3 P48764 1/20 0.33
BDKRB1 P46663 1/20 0.33
POLB P06746 1/20 0.33
HPGD P15428 1/20 0.33
GAA P10253 1/20 0.33

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
SCHEMBL493534 0.82 ACLY (0.36) ALDH1A1L3MBTL1KDM4ETDP1ACLY
SCHEMBL493566 0.78 BDKRB1 (0.42) ALDH1A1L3MBTL1KDM4ETDP1BDKRB1
SCHEMBL642948 0.78 GAA (0.48) ALDH1A1L3MBTL1KDM4EFABP4GAA
SCHEMBL644589 0.77 GAA (0.47) ALDH1A1L3MBTL1KDM4EFABP4GAA
SCHEMBL5130046 0.72 KDM4E (0.46) KDM4ETDP1BDKRB1
SCHEMBL493606 0.71 ACLY (0.38) ALDH1A1L3MBTL1KDM4EACLY
SCHEMBL4475597 0.70 KDM4E (0.41) KDM4ETDP1BDKRB1HPGD
SCHEMBL645268 0.69 MAPT (0.45) L3MBTL1KDM4EACLY
SCHEMBL4484352 0.68 BDKRB1 (0.51) BDKRB1
SCHEMBL4032633 0.67 HTT (0.48) ALDH1A1L3MBTL1KDM4EBDKRB1GAA

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-8106055-B2 Substituted amide compounds GRUENENTHAL GMBH (DE) 2012-01-31 US disclosed
EP-2139851-A2 SUBSTITUTED AMIDE DERIVATIVES Grünenthal GmbH (DE) 2010-01-06 EP disclosed
US-20080306084-A1 Substituted Amide Compounds GRUENENTHAL GMBH (DE) 2008-12-11 US disclosed
WO-2008131946-A2 SUBSTITUTED AMIDE DERIVATIVES Grünenthal GmbH (DE) 2008-11-06 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 (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-20080306084-A1 Substituted Amide Compounds OPRK1, NAA50, ACMSD ALDH1A1 1349/4885L3MBTL1 4753/4885RXRA 1068/4885

“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.