SCHEMBL3817064

SCHEMBL3817064

Cc1cc(C)c(S(=O)(=O)N2Cc3ccccc3CC2COCC(=O)N2CCC(O)(c3ccccc3)CC2)c(C)c1

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 3/20 0.38
MEN1 O00255 5/20 0.36
KMT2A Q03164 5/20 0.36
POLB P06746 1/20 0.35
CYP46A1 Q9Y6A2 1/20 0.35
RORC P51449 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
CA12 O43570 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA7 P43166 1/20 0.34
CA9 Q16790 1/20 0.34
CA14 Q9ULX7 1/20 0.34
OPRM1 P35372 1/20 0.34
OPRD1 P41143 1/20 0.34
OPRK1 P41145 1/20 0.34

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
SCHEMBL3837762 0.94 MEN1 (0.44) EPHX2MEN1KMT2A
SCHEMBL5132300 0.89 CYP46A1 (0.40) EPHX2MEN1KMT2ACYP46A1OPRM1
SCHEMBL5131290 0.86 ALDH1A1 (0.45) MEN1KMT2APOLB
SCHEMBL5131291 0.86 ALDH1A1 (0.45) MEN1KMT2APOLB
SCHEMBL5127128 0.83 EPHX2 (0.43) EPHX2MEN1KMT2APOLBL3MBTL1
SCHEMBL5128012 0.83 BDKRB1 (0.43) EPHX2POLBRORCL3MBTL1CA12
SCHEMBL5132545 0.82 MEN1 (0.41) MEN1KMT2APOLB
SCHEMBL5131980 0.82 EPHX2 (0.43) EPHX2POLB
SCHEMBL2566064 0.82 BDKRB1 (0.40) EPHX2MEN1KMT2AOPRD1OPRK1
SCHEMBL2564167 0.82 BDKRB1 (0.48) EPHX2MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2086935-A1 SUBSTITUTED SULFONAMIDE DERIVATIVES FOR USE AS BRADYKININ 1 RECEPTOR MODULATORS Grünenthal GmbH (DE) 2009-08-12 EP claimed
US-20080249128-A1 Substituted Sulfonamide Compounds GRUENENTHAL GMBH (DE) 2008-10-09 US claimed
WO-2008046573-A1 SUBSTITUTED SULFONAMIDE DERIVATIVES FOR USE AS BRADYKININ 1 RECEPTOR MODULATORS Grünenthal GmbH (DE) 2008-04-24 WO 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 1287/4885MEN1 1340/4885KMT2A 2892/4885

“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.