SCHEMBL7399254

SCHEMBL7399254

Clc1ccc(-c2ccc(OC/C=C\c3ccc4ccccc4c3Br)cc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP3 P08254 2/20 0.43
PTGES O14684 1/20 0.39
MAOB P27338 1/20 0.38
PDE10A Q9Y233 2/20 0.36
MEN1 O00255 3/20 0.36
KMT2A Q03164 3/20 0.36
MAPT P10636 2/20 0.36
KDM4E B2RXH2 2/20 0.36
HTT P42858 1/20 0.35
ALOX5AP P20292 2/20 0.35
L3MBTL1 Q9Y468 2/20 0.34
NPC1 O15118 2/20 0.33
RAB9A P51151 2/20 0.33
ALDH1A1 P00352 1/20 0.33
XBP1 P17861 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
ALOX15 P16050 1/20 0.33
TSHR P16473 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
GAA P10253 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
SCHEMBL7399256 1.00 MMP3 (0.43) MMP3PTGESMAOBPDE10AMEN1
SCHEMBL7990037 0.81 MMP3 (0.50) MMP3PTGESMAPTALOX5APL3MBTL1
SCHEMBL7990034 0.81 MMP3 (0.50) MMP3PTGESMAPTALOX5APL3MBTL1
SCHEMBL7996795 0.73 MMP3 (0.66) MMP3MAPTL3MBTL1TDP1RXFP1
SCHEMBL7990497 0.72 MAOB (0.48) MAOBMAPTL3MBTL1NPC1RAB9A
SCHEMBL7990495 0.72 MAOB (0.48) MAOBMAPTL3MBTL1NPC1RAB9A
SCHEMBL7399437 0.70 MAOB (0.51) MAOBMAPTL3MBTL1NPC1RAB9A
SCHEMBL27752593 0.70 AOC3 (0.49) CHRNB4CHRNA3CHRNA7
SCHEMBL3267323 0.70 MAOB (0.48) MAOBMAPTNPC1RAB9AALDH1A1
SCHEMBL3267319 0.70 MAOB (0.48) MAOBMAPTNPC1RAB9AALDH1A1

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
US-6288261-B1 DRUGS FOR INHIBITION OF ENZYMES ABBOTT LABORATORIES 2001-09-11 US disclosed
WO-2000037433-A1 INHIBITORS OF MATRIX METALLOPROTEINASES ABBOTT LABORATORIES (US) 2000-06-29 WO disclosed