SCHEMBL4091715

SCHEMBL4091715

COc1cc(C)c(S(=O)(=O)N(CCOCC(=O)N2CCn3cccc3C2C(C)C)CC(C)C)c(C)c1C

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
BDKRB1 P46663 15/20 0.37
EPHX2 P34913 1/20 0.33
BMP1 P13497 2/20 0.33
MMP8 P22894 2/20 0.33
MMP1 P03956 1/20 0.33
AVPR1B P47901 1/20 0.32
HTR6 P50406 1/20 0.32

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
SCHEMBL4085935 0.91 AVPR1A (0.39) BDKRB1BMP1MMP8MMP1AVPR1B
SCHEMBL4080766 0.91 BDKRB1 (0.38) BDKRB1AVPR1B
SCHEMBL4084973 0.90 BDKRB1 (0.46) BDKRB1HTR6
SCHEMBL4091422 0.90 BDKRB1 (0.36) BDKRB1EPHX2BMP1MMP8
SCHEMBL4081206 0.89 ALDH1A1 (0.37) BDKRB1BMP1MMP8AVPR1B
SCHEMBL4080745 0.89 BDKRB1 (0.37) BDKRB1
SCHEMBL4093356 0.88 BDKRB1 (0.38) BDKRB1
SCHEMBL4086264 0.87 SHMT2 (0.44) BDKRB1EPHX2BMP1MMP8MMP1
SCHEMBL4085352 0.87 MEN1 (0.34) BDKRB1BMP1MMP8MMP1AVPR1B
SCHEMBL4080320 0.87 BDKRB1 (0.37) 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 1/4885EPHX2 1541/4885BMP1 2342/4885

“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.