SCHEMBL3405377

SCHEMBL3405377

CN1CCN(C2(c3cccc(F)c3)CCN(C(=O)CC(NS(=O)(=O)c3ccc4ccccc4c3)c3ccccc3)CC2)CC1

nearest known ligand 0.45

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 1/20 0.45
BDKRB1 P46663 17/20 0.44
BDKRB2 P30411 7/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
ALDH1A1 P00352 1/20 0.41
HSD17B10 Q99714 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
SCHEMBL3410238 0.93 BDKRB1 (0.47) RAB9ABDKRB1BDKRB2MEN1KMT2A
SCHEMBL3404305 0.92 RAB9A (0.50) RAB9ABDKRB1BDKRB2MEN1KMT2A
SCHEMBL3318290 0.89 BDKRB1 (0.46) RAB9ABDKRB1BDKRB2MEN1KMT2A
SCHEMBL4374587 0.83 BDKRB1 (0.47) RAB9ABDKRB1BDKRB2MEN1KMT2A
SCHEMBL3409680 0.82 BDKRB1 (0.48) RAB9ABDKRB1BDKRB2MEN1KMT2A
SCHEMBL3411012 0.81 BDKRB1 (0.44) RAB9ABDKRB1BDKRB2MEN1KMT2A
SCHEMBL3408526 0.81 BDKRB1 (0.49) RAB9ABDKRB1BDKRB2MEN1KMT2A
SCHEMBL3406741 0.81 BDKRB1 (0.47) RAB9ABDKRB1BDKRB2MEN1KMT2A
SCHEMBL645024 0.80 CACNA2D1 (0.51) BDKRB1BDKRB2
SCHEMBL3407301 0.80 BDKRB1 (0.48) BDKRB1BDKRB2MEN1KMT2A

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 RAB9A 2485/4885BDKRB1 3589/4885BDKRB2 3132/4885

“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.