SCHEMBL6024696

SCHEMBL6024696

CCCCOC(=O)Nc1ccccc1C(=O)Cl

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 7/20 0.75
CYP1A2 P05177 3/20 0.75
CYP2C19 P33261 3/20 0.75
ALDH1A1 P00352 8/20 0.65
L3MBTL1 Q9Y468 6/20 0.54
TSHR P16473 5/20 0.54
TDP1 Q9NUW8 2/20 0.54
LMNA P02545 3/20 0.53
NPSR1 Q6W5P4 1/20 0.53
HPGD P15428 5/20 0.52
KDM4E B2RXH2 3/20 0.52
RAB9A P51151 7/20 0.49
MAPK1 P28482 3/20 0.49
CYP3A4 P08684 2/20 0.49
TP53 P04637 1/20 0.49
MAPT P10636 2/20 0.48
NPC1 O15118 6/20 0.48
NFKB1 P19838 1/20 0.48
STAT1 P42224 1/20 0.48
NFKB2 Q00653 1/20 0.48

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
SCHEMBL2320061 0.87 SMN1; SMN2 (0.77) SMN1; SMN2CYP1A2CYP2C19ALDH1A1L3MBTL1
SCHEMBL11421007 0.85 MEN1 (0.62) SMN1; SMN2CYP1A2CYP2C19ALDH1A1TSHR
SCHEMBL3135286 0.84 SMN1; SMN2 (0.82) SMN1; SMN2CYP1A2CYP2C19ALDH1A1L3MBTL1
SCHEMBL10916752 0.83 SMN1; SMN2 (0.76) SMN1; SMN2CYP1A2CYP2C19ALDH1A1L3MBTL1
SCHEMBL21059156 0.82 SMN1; SMN2 (0.66) SMN1; SMN2CYP1A2CYP2C19ALDH1A1L3MBTL1
SCHEMBL22822387 0.82 SMN1; SMN2 (0.70) SMN1; SMN2CYP1A2CYP2C19ALDH1A1L3MBTL1
SCHEMBL7378894 0.81 SMN1; SMN2 (0.68) SMN1; SMN2CYP1A2CYP2C19ALDH1A1L3MBTL1
SCHEMBL13506223 0.81 SMN1; SMN2 (0.68) SMN1; SMN2CYP1A2CYP2C19ALDH1A1L3MBTL1
SCHEMBL3867996 0.81 SMN1; SMN2 (0.68) SMN1; SMN2CYP1A2CYP2C19ALDH1A1L3MBTL1
SCHEMBL8057145 0.80 SMN1; SMN2 (0.67) SMN1; SMN2CYP1A2CYP2C19ALDH1A1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1685119-A1 N-ACYLSULFONAMIDE APOPTOSIS PROMOTERS Abbott Laboratories (US) 2006-08-02 EP disclosed
WO-2005049593-A2 N-ACYLSULFONAMIDE APOPTOSIS PROMOTERS ABBOTT LABORATORIES (US) 2005-06-02 WO disclosed
WO-2005049594-A1 N-ACYLSULFONAMIDE APOPTOSIS PROMOTERS ABBOTT LABORATORIES (US) 2005-06-02 WO disclosed