SCHEMBL2492763

SCHEMBL2492763

CCCCCN(C)S(=O)(=O)c1c(Cl)cc(Cl)cc1Cl.O=C(O)NC1CCC(C(c2ccccc2)N2CCCCC2)CC1

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CACNA2D1 P54289 4/20 0.38
CACNA1B Q00975 4/20 0.38
CACNB1 Q02641 4/20 0.38
CACNA1C Q13936 4/20 0.38
CNR1 P21554 4/20 0.36
CNR2 P34972 4/20 0.36
ICMT O60725 1/20 0.35
ALB P02768 1/20 0.35
TSHR P16473 1/20 0.35
CCR5 P51681 1/20 0.35
RAB9A P51151 1/20 0.34
APLNR P35414 3/20 0.34
ALDH1A1 P00352 1/20 0.34
LMNA P02545 1/20 0.34
CHRM3 P20309 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
SCHEMBL644329 0.90 CACNA2D1 (0.37) CACNA2D1CACNA1BCACNB1CACNA1CCNR1
SCHEMBL2489242 0.86 ICMT (0.35) CNR1CNR2ICMTALBCCR5
SCHEMBL492596 0.84 ALDH1A1 (0.37) CACNA2D1CACNA1BCACNB1CACNA1CCNR1
SCHEMBL492975 0.83 CACNA2D1 (0.37) CACNA2D1CACNA1BCACNB1CACNA1CCNR1
SCHEMBL493117 0.77 CACNA2D1 (0.42) CACNA2D1CACNA1BCACNB1CACNA1CCCR5
SCHEMBL493013 0.77 MEN1 (0.37) CACNA2D1CACNA1BCACNB1CACNA1CCNR2
SCHEMBL492867 0.77 BDKRB1 (0.39) CACNA2D1CACNA1BCACNB1CACNA1CCNR1
SCHEMBL492976 0.76 ALDH1A1 (0.37) CACNA2D1CACNA1BCACNB1CACNA1CCNR1
SCHEMBL493688 0.76 PTGIR (0.37) CACNA2D1CACNA1BCACNB1CACNA1CRAB9A
SCHEMBL493360 0.76 LMNA (0.39) ALDH1A1LMNA

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2150530-B1 SUBSTITUTED SULFONAMIDE DERIVATIVES GRUENENTHAL GMBH (DE) 2011-10-26 EP claimed
EP-2150530-A1 SUBSTITUTED SULFONAMIDE DERIVATIVES Grünenthal GmbH (DE) 2010-02-10 EP claimed
WO-2008131947-A1 SUBSTITUTED SULFONAMIDE DERIVATIVES Grünenthal GmbH (DE) 2008-11-06 WO claimed
EP-2150530-B1 SUBSTITUTED SULFONAMIDE DERIVATIVES GRUENENTHAL GMBH (DE) 2011-10-26 EP disclosed