SCHEMBL4374697

SCHEMBL4374697

Cc1cc(S(=O)(=O)N2CCCCC2CCC(=O)N2CCC(CN)(N3CCN(C)CC3)CC2)c(C)cc1Cl

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HCRTR1 O43613 1/20 0.40
HCRTR2 O43614 1/20 0.40
BDKRB1 P46663 9/20 0.38
MAPT P10636 1/20 0.35
THRB P10828 1/20 0.35
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
PSEN1 P49768 1/20 0.33
PSEN2 P49810 1/20 0.33
APH1B Q8WW43 1/20 0.33
NCSTN Q92542 1/20 0.33
APH1A Q96BI3 1/20 0.33
PSENEN Q9NZ42 1/20 0.33
EPHX2 P34913 1/20 0.33

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
SCHEMBL3409770 0.89 HCRTR1 (0.40) HCRTR1HCRTR2BDKRB1MAPTTHRB
SCHEMBL3408874 0.89 HCRTR1 (0.38) HCRTR1HCRTR2BDKRB1
SCHEMBL3407853 0.87 HCRTR1 (0.37) HCRTR1HCRTR2BDKRB1
SCHEMBL3405897 0.85 HCN4 (0.41) HCRTR1HCRTR2THRB
SCHEMBL3407195 0.85 HCRTR1 (0.39) HCRTR1HCRTR2BDKRB1
SCHEMBL3402481 0.84 TP53 (0.37) HCRTR1HCRTR2THRBMEN1KMT2A
SCHEMBL3405986 0.84 MC4R (0.40)
SCHEMBL3404248 0.84 HCRTR1 (0.38) HCRTR1HCRTR2BDKRB1MAPT
SCHEMBL3407032 0.83 HCN4 (0.40) HCRTR1HCRTR2
SCHEMBL3412223 0.82 BDKRB1 (0.36) HCRTR1HCRTR2BDKRB1MAPT

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
US-8541573-B2 Substituted sulfonamide compounds GRUENENTHAL GMBH (DE) 2013-09-24 US disclosed
US-8541573-B2 Substituted sulfonamide compounds GRUENENTHAL GMBH (DE) 2013-09-24 US disclosed
US-8541573-B2 Substituted sulfonamide compounds GRUENENTHAL GMBH (DE) 2013-09-24 US disclosed
US-20090298812-A1 Substituted Sulfonamide Compounds GRUENENTHAL GMBH (DE) 2009-12-03 US disclosed
US-20090298812-A1 Substituted Sulfonamide Compounds GRUENENTHAL GMBH (DE) 2009-12-03 US 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 HCRTR1 558/4885HCRTR2 652/4885BDKRB1 1/4885

“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.