SCHEMBL3408874

SCHEMBL3408874

Cc1cc(S(=O)(=O)N2CCCCC2CCC(=O)N2CCC(Cc3ccccc3)(N3CCN(C)CC3)CC2)c(C)cc1Cl

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HCRTR1 O43613 1/20 0.38
HCRTR2 O43614 1/20 0.38
LMNA P02545 1/20 0.36
MAPK1 P28482 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
BDKRB1 P46663 4/20 0.36
ACLY P53396 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
FKBP1A P62942 1/20 0.34
HTR7 P34969 3/20 0.34
HTR1D P28221 2/20 0.34
HTR2B P41595 2/20 0.34
HTR1A P08908 1/20 0.34
DRD2 P14416 1/20 0.34
DRD3 P35462 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
SCHEMBL3407853 0.93 HCRTR1 (0.37) HCRTR1HCRTR2LMNAMAPK1SMN1; SMN2
SCHEMBL3405986 0.90 MC4R (0.40) LMNA
SCHEMBL4374697 0.89 HCRTR1 (0.40) HCRTR1HCRTR2BDKRB1
SCHEMBL3407195 0.88 HCRTR1 (0.39) HCRTR1HCRTR2BDKRB1ACLYHTR7
SCHEMBL3405897 0.88 HCN4 (0.41) HCRTR1HCRTR2LMNATDP1
SCHEMBL3408684 0.88 BDKRB1 (0.40) HCRTR1HCRTR2LMNAMAPK1SMN1; SMN2
SCHEMBL3409770 0.86 HCRTR1 (0.40) HCRTR1HCRTR2LMNABDKRB1
SCHEMBL3407032 0.84 HCN4 (0.40) HCRTR1HCRTR2LMNAMAPK1
SCHEMBL3408728 0.84 BDKRB1 (0.40) HCRTR1HCRTR2LMNAMAPK1SMN1; SMN2
SCHEMBL3402481 0.83 TP53 (0.37) HCRTR1HCRTR2LMNA

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 HCRTR1 4142/4885HCRTR2 3980/4885LMNA 2546/4885

“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.