SCHEMBL2490288

SCHEMBL2490288

CN(C)c1ccccc1CC1CCC(CNC(=O)C2Cc3ccccc3N2S(=O)(=O)c2ccc(Cl)c(Cl)c2)CC1

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CACNA1H O95180 1/20 0.43
BDKRB1 P46663 4/20 0.40
PTGER3 P43115 1/20 0.40
LMNA P02545 3/20 0.38
TP53 P04637 1/20 0.38
ALDH1A1 P00352 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
POLB P06746 1/20 0.36
GAA P10253 1/20 0.36
KMT2A Q03164 1/20 0.36
MAPK1 P28482 1/20 0.36
GNRHR P30968 1/20 0.36

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
SCHEMBL642869 0.83 CACNA1H (0.42) CACNA1HBDKRB1PTGER3TP53ALDH1A1
SCHEMBL643833 0.82 BDKRB1 (0.41) CACNA1HBDKRB1PTGER3
SCHEMBL645419 0.75 BDKRB1 (0.42) BDKRB1PTGER3
SCHEMBL927220 0.75 BDKRB1 (0.51) BDKRB1PTGER3GAAKMT2A
SCHEMBL2489904 0.74 KMT2A (0.45) LMNAALDH1A1L3MBTL1GAAKMT2A
SCHEMBL644139 0.73 ALDH1A1 (0.47) BDKRB1PTGER3LMNAALDH1A1TDP1
SCHEMBL643004 0.73 ALDH1A1 (0.48) BDKRB1PTGER3LMNAALDH1A1TDP1
SCHEMBL643253 0.71 BDKRB1 (0.43) BDKRB1PTGER3LMNA
SCHEMBL644671 0.70 LMNA (0.43) BDKRB1PTGER3LMNATP53ALDH1A1
SCHEMBL4036560 0.70 TRPA1 (0.45) LMNATP53

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