SCHEMBL3409743

SCHEMBL3409743

Cc1cccc(Cl)c1S(=O)(=O)N1CCCCC1CCCC(=O)N1CCC(c2cccc(F)c2)(N2CCN(C)CC2)CC1

nearest known ligand 0.34

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 4/20 0.34
ALDH1A1 P00352 2/20 0.34
GAA P10253 1/20 0.33
PKM P14618 1/20 0.33
NPC1 O15118 1/20 0.32
MCHR1 Q99705 1/20 0.32
HTR7 P34969 3/20 0.32
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2D6 P10635 1/20 0.31
CYP2C19 P33261 1/20 0.31
PSEN1 P49768 1/20 0.31
PSEN2 P49810 1/20 0.31
APH1B Q8WW43 1/20 0.31
NCSTN Q92542 1/20 0.31
APH1A Q96BI3 1/20 0.31
PSENEN Q9NZ42 1/20 0.31

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
SCHEMBL3407245 0.89 NPC1 (0.36) NPC1HTR7
SCHEMBL3412223 0.85 BDKRB1 (0.36) ALDH1A1NPC1HTR7
SCHEMBL4299091 0.84 ALDH1A1 (0.35) CCR1ALDH1A1HTR7
SCHEMBL3408252 0.84 HTR7 (0.47) HTR7
SCHEMBL3412242 0.84 CCR4 (0.37) ALDH1A1GAAPKMHTR7
SCHEMBL3409977 0.83 HTR7 (0.37) ALDH1A1GAAMCHR1HTR7
SCHEMBL12694771 0.81 NPC1 (0.36) ALDH1A1NPC1HTR7CYP3A4CYP2D6
SCHEMBL12694732 0.80 HSD17B10 (0.35) CCR1ALDH1A1NPC1CYP3A4PSEN1
SCHEMBL3410519 0.80 BDKRB1 (0.38) NPC1
SCHEMBL3408836 0.80 BDKRB1 (0.43) HTR7

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 8 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
US-20090253669-A1 Substituted Sulfonamide Compounds GRUENENTHAL GMBH (DE) 2009-10-08 US 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 CCR1 3809/4885ALDH1A1 863/4885GAA 621/4885

“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.