SCHEMBL4081145

SCHEMBL4081145

COc1cc(C)c(S(=O)(=O)N(CCOCC(=O)N2CCn3c(CN(C)C)ccc3C2c2cccs2)CC(C)C)c(C)c1C

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
BDKRB1 P46663 14/20 0.35
AVPR1B P47901 2/20 0.32
KDM4E B2RXH2 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
MMP1 P03956 1/20 0.31
BMP1 P13497 1/20 0.31
MMP8 P22894 1/20 0.31
AVPR1A P37288 1/20 0.31

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
SCHEMBL4084369 0.91 AVPR1A (0.37) BDKRB1AVPR1BBMP1MMP8AVPR1A
SCHEMBL4095908 0.90 BDKRB1 (0.36) BDKRB1AVPR1BBMP1MMP8AVPR1A
SCHEMBL4085352 0.86 MEN1 (0.34) BDKRB1AVPR1BKDM4EMEN1KMT2A
SCHEMBL4086349 0.86 BDKRB1 (0.39) BDKRB1MEN1KMT2A
SCHEMBL4090950 0.85 AVPR1B (0.37) BDKRB1AVPR1BBMP1MMP8AVPR1A
SCHEMBL4080772 0.84 BDKRB1 (0.38) BDKRB1AVPR1BAVPR1A
SCHEMBL4095402 0.84 AVPR1B (0.36) BDKRB1AVPR1BBMP1MMP8AVPR1A
SCHEMBL4081157 0.83 BDKRB1 (0.43) BDKRB1
SCHEMBL4081176 0.82 BDKRB1 (0.51) BDKRB1
SCHEMBL4091193 0.81 BDKRB1 (0.42) BDKRB1

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-8263598-B2 Substituted sulfonamide compounds GRUENENTHAL GMBH (DE) 2012-09-11 US claimed
US-20090186899-A1 Substituted Sulfonamide Compounds GRUENENTHAL GMBH (DE) 2009-07-23 US claimed
US-8263598-B2 Substituted sulfonamide compounds GRUENENTHAL GMBH (DE) 2012-09-11 US disclosed
US-20090186899-A1 Substituted Sulfonamide Compounds GRUENENTHAL GMBH (DE) 2009-07-23 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-20090186899-A1 Substituted Sulfonamide Compounds BDKRB1, BDKRB2, NPSR1 BDKRB1 1/4885AVPR1B 64/4885KDM4E 3293/4885

“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.