SCHEMBL3402979

SCHEMBL3402979

COc1cc(C)c(S(=O)(=O)N2c3ccccc3CC2COCC(=O)N2CCC(CNC(=O)c3ccncc3)(N3CCN(C4CC4)CC3)CC2)c(C)c1

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
BDKRB1 P46663 11/20 0.40
HCN1 O60741 5/20 0.37
TP53 P04637 1/20 0.35
HCN4 Q9Y3Q4 3/20 0.35
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
NPC1 O15118 1/20 0.34
GAA P10253 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
SCHEMBL3402976 1.00 BDKRB1 (0.40) BDKRB1HCN1TP53HCN4MEN1
SCHEMBL3408612 0.85 TP53 (0.40) BDKRB1HCN1TP53HCN4MEN1
SCHEMBL3408994 0.81 TP53 (0.45) BDKRB1HCN1TP53HCN4MEN1
SCHEMBL3407674 0.79 BDKRB1 (0.55) BDKRB1TP53
SCHEMBL3405241 0.77 TP53 (0.46) BDKRB1HCN1TP53HCN4MEN1
SCHEMBL3406395 0.76 TP53 (0.44) BDKRB1HCN1TP53MEN1KMT2A
SCHEMBL3409365 0.76 BDKRB1 (0.51) BDKRB1
SCHEMBL2564813 0.75 BDKRB1 (0.59) BDKRB1
SCHEMBL3402965 0.75 TP53 (0.41) BDKRB1HCN1TP53MEN1KMT2A
SCHEMBL3402509 0.75 HCN4 (0.37) HCN1TP53HCN4NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2254867-A1 SUBSTITUTED SULFONAMIDE DERIVATIVES Grünenthal Gmbh (DE) 2010-12-01 EP claimed
US-20090298812-A1 Substituted Sulfonamide Compounds GRUENENTHAL GMBH (DE) 2009-12-03 US claimed
WO-2009109364-A1 SUBSTITUTED SULFONAMIDE DERIVATIVES Grünenthal GmbH (DE) 2009-09-11 WO claimed
US-8541573-B2 Substituted sulfonamide compounds GRUENENTHAL GMBH (DE) 2013-09-24 US disclosed
EP-2254867-A1 SUBSTITUTED SULFONAMIDE DERIVATIVES Grünenthal Gmbh (DE) 2010-12-01 EP disclosed
US-20090298812-A1 Substituted Sulfonamide Compounds GRUENENTHAL GMBH (DE) 2009-12-03 US disclosed
WO-2009109364-A1 SUBSTITUTED SULFONAMIDE DERIVATIVES Grünenthal GmbH (DE) 2009-09-11 WO 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-20090298812-A1 Substituted Sulfonamide Compounds BDKRB1, BDKRB2, TRPV1 BDKRB1 1/4885HCN1 426/4885TP53 4231/4885

“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.