SCHEMBL3409945

SCHEMBL3409945

CN(CCC1CCC(c2ccccc2)(N(C)C)CC1)C(=O)CC(NS(=O)(=O)c1ccc2ccccc2c1)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
BDKRB1 P46663 18/20 0.48
BDKRB2 P30411 5/20 0.43
CYP1A2 P05177 2/20 0.41
CYP3A4 P08684 2/20 0.41
CYP2C9 P11712 2/20 0.41
TSHR P16473 2/20 0.41
CYP2C19 P33261 2/20 0.41
MAPT P10636 1/20 0.41
PKM P14618 1/20 0.41

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
SCHEMBL3408165 0.87 BDKRB1 (0.49) BDKRB1BDKRB2
SCHEMBL3410852 0.87 BDKRB1 (0.48) BDKRB1BDKRB2
SCHEMBL3406147 0.85 BDKRB1 (0.47) BDKRB1BDKRB2
SCHEMBL3413298 0.83 BDKRB1 (0.48) BDKRB1BDKRB2
SCHEMBL3409734 0.83 BDKRB1 (0.49) BDKRB1BDKRB2
SCHEMBL3410837 0.82 BDKRB1 (0.49) BDKRB1BDKRB2
SCHEMBL3410941 0.80 BDKRB1 (0.49) BDKRB1BDKRB2
SCHEMBL3409972 0.79 BDKRB1 (0.48) BDKRB1BDKRB2
SCHEMBL3408504 0.78 BDKRB1 (0.48) BDKRB1BDKRB2
SCHEMBL3311108 0.77 BDKRB1 (0.47) BDKRB1BDKRB2PKM

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
EP-2257527-A1 SUBSTITUTED SULFONAMIDE DERIVATIVES Grünenthal GmbH (DE) 2010-12-08 EP claimed
US-20090253669-A1 Substituted Sulfonamide Compounds GRUENENTHAL GMBH (DE) 2009-10-08 US claimed
WO-2009115257-A1 SUBSTITUTED SULFONAMIDE DERIVATIVES Grünenthal GmbH (DE) 2009-09-24 WO claimed
EP-2257527-A1 SUBSTITUTED SULFONAMIDE DERIVATIVES Grünenthal GmbH (DE) 2010-12-08 EP disclosed
US-20090253669-A1 Substituted Sulfonamide Compounds GRUENENTHAL GMBH (DE) 2009-10-08 US disclosed
WO-2009115257-A1 SUBSTITUTED SULFONAMIDE DERIVATIVES Grünenthal GmbH (DE) 2009-09-24 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-20090253669-A1 Substituted Sulfonamide Compounds SULT2A1, STS, SULT1A1 BDKRB1 3589/4885BDKRB2 3132/4885CYP1A2 148/4885

“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.