SCHEMBL5123711

SCHEMBL5123711

COc1cc(C)c(S(=O)(=O)N2CCC(OCC(=O)O)CC2)c(C)c1C

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 2/20 0.53
TSHR P16473 1/20 0.43
HTR6 P50406 1/20 0.41
FPR2 P25090 4/20 0.40
PROKR1 Q8TCW9 4/20 0.40
NPC1 O15118 1/20 0.39
APEX1 P27695 2/20 0.39
POLB P06746 1/20 0.39
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
AVPR1A P37288 1/20 0.38
AVPR1B P47901 1/20 0.38
MAPK1 P28482 1/20 0.38

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
SCHEMBL5125598 0.94 EPHX2 (0.49) EPHX2TSHRHTR6FPR2PROKR1
SCHEMBL5132127 0.87 EPHX2 (0.46) EPHX2TSHRHTR6POLBMEN1
SCHEMBL5131959 0.84 EPHX2 (0.53) EPHX2TSHRHTR6FPR2PROKR1
SCHEMBL5128634 0.81 EPHX2 (0.42) EPHX2MEN1KMT2AMAPK1
SCHEMBL3808499 0.80 EPHX2 (0.44) EPHX2HTR6FPR2PROKR1MEN1
SCHEMBL4111436 0.79 BDKRB1 (0.41) EPHX2TSHRFPR2PROKR1MEN1
SCHEMBL5128261 0.78 EPHX2 (0.47) EPHX2AVPR1AAVPR1BMAPK1
SCHEMBL5088905 0.78 EPHX2 (0.52) EPHX2TSHRHTR6FPR2PROKR1
SCHEMBL4119445 0.77 EPHX2 (0.49) EPHX2MEN1KMT2AMAPK1
SCHEMBL493396 0.75 EPHX2 (0.44) EPHX2HTR6MEN1KMT2AAVPR1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8580965-B2 Substituted sulfonamide compounds GRUENENTHAL GMBH (DE) 2013-11-12 US disclosed
US-8580965-B2 Substituted sulfonamide compounds GRUENENTHAL GMBH (DE) 2013-11-12 US disclosed
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
US-20080249128-A1 Substituted Sulfonamide Compounds GRUENENTHAL GMBH (DE) 2008-10-09 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 1287/4885TSHR 645/4885HTR6 526/4885

“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.