SCHEMBL995317

SCHEMBL995317

CCCCOC(=O)NOC(=O)C(C)N1CCN(Cc2ccc(C)cc2)CC1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.44
ATM Q13315 1/20 0.44
LMNA P02545 1/20 0.43
RAB9A P51151 4/20 0.42
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
NPC1 O15118 3/20 0.42
TP53 P04637 2/20 0.42
GAA P10253 1/20 0.42
DRD4 P21917 1/20 0.41
FAAH O00519 1/20 0.39
TSHR P16473 1/20 0.39
S1PR5 Q9H228 1/20 0.39
HPGD P15428 1/20 0.39
CYP2D6 P10635 1/20 0.39
CACNA1G O43497 1/20 0.39
HRH3 Q9Y5N1 1/20 0.39
TLR7 Q9NYK1 1/20 0.39

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
SCHEMBL996067 0.91 MAPK1 (0.49) ALDH1A1ATMLMNARAB9AMEN1
SCHEMBL995867 0.88 L3MBTL1 (0.47) ALDH1A1MEN1KMT2AFAAHCACNA1G
SCHEMBL16054124 0.82 KDM4E (0.39) ALDH1A1LMNARAB9AKMT2ANPC1
SCHEMBL995318 0.78 MEN1 (0.45) ALDH1A1ATMLMNARAB9AMEN1
SCHEMBL16054933 0.75 HRH2 (0.41) ALDH1A1LMNARAB9AKMT2ANPC1
SCHEMBL1000039 0.75 SMN1; SMN2 (0.49) ALDH1A1LMNARAB9AKMT2ANPC1
SCHEMBL16054685 0.75 SIGMAR1 (0.38) RAB9AKMT2ANPC1TP53HPGD
SCHEMBL995979 0.74 TDP1 (0.41) ALDH1A1RAB9AMEN1KMT2ANPC1
SCHEMBL995315 0.73 ALDH1A1 (0.44) ALDH1A1ATMLMNARAB9AMEN1
SCHEMBL996324 0.72 EPHX2 (0.35) ALDH1A1LMNARAB9AKMT2ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2448920-A1 NOVEL BENZENESULFONAMIDE COMPOUNDS, METHOD FOR SYNTHESIZING SAME, AND USE THEREOF IN MEDICINE AS WELL AS IN COSMETICS Galderma Research & Development (FR) 2012-05-09 EP disclosed
WO-2011001089-A1 NOVEL BENZENESULFONAMIDE COMPOUNDS, METHOD FOR SYNTHESIZING SAME, AND USE THEREOF IN MEDICINE AS WELL AS IN COSMETICS GALDERMA RESEARCH & DEVELOPMENT (FR) 2011-01-06 WO disclosed