SCHEMBL4345307

SCHEMBL4345307

COc1cc(C)c(S(=O)(=O)N2CCCCC2CCOCC(=O)N2CCc3[nH]cnc3C2c2ccccc2)c(C)c1

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
BDKRB1 P46663 11/20 0.38
AOC3 Q16853 1/20 0.37
RAB9A P51151 2/20 0.36
NPC1 O15118 1/20 0.36
FKBP1A P62942 1/20 0.34
LMNA P02545 1/20 0.34
TP53 P04637 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
SCHEMBL4353803 0.90 RAB9A (0.38) AOC3RAB9ANPC1FKBP1ALMNA
SCHEMBL4353756 0.90 AOC3 (0.38) BDKRB1AOC3RAB9ANPC1FKBP1A
SCHEMBL4348181 0.82 BDKRB1 (0.52) BDKRB1
SCHEMBL4356188 0.81 AVPR1A (0.36) BDKRB1AOC3TP53
SCHEMBL4348168 0.81 BDKRB1 (0.43) BDKRB1AOC3
SCHEMBL4345057 0.80 BDKRB1 (0.44) BDKRB1AOC3
SCHEMBL4345303 0.79 NPC1 (0.39) BDKRB1AOC3RAB9ANPC1LMNA
SCHEMBL4341780 0.78 NPC1 (0.35) AOC3RAB9ANPC1LMNATP53
SCHEMBL3638390 0.76 BDKRB1 (0.46) BDKRB1RAB9ANPC1FKBP1A
SCHEMBL700897 0.76 BDKRB1 (0.46) BDKRB1RAB9ANPC1FKBP1A

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-8268814-B2 Substituted sulfonamide compounds GRUENENTHAL GMBH (DE) 2012-09-18 US claimed
US-20090275558-A1 SUBSTITUTED SULFONAMIDE COMPOUNDS GRUENENTHAL GMBH (DE) 2009-11-05 US claimed
US-8268814-B2 Substituted sulfonamide compounds GRUENENTHAL GMBH (DE) 2012-09-18 US disclosed
US-20090275558-A1 SUBSTITUTED SULFONAMIDE COMPOUNDS GRUENENTHAL GMBH (DE) 2009-11-05 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-20090275558-A1 SUBSTITUTED SULFONAMIDE COMPOUNDS BDKRB2, BDKRB1, TRPV1 BDKRB1 2/4885AOC3 4024/4885RAB9A 3216/4885

“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.