SCHEMBL7487118

SCHEMBL7487118

O=C(COc1ccc2ccccc2c1C(=O)NO)c1ccc(-c2ccc(Cl)cc2)cc1

nearest known ligand 0.65

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MMP3 P08254 10/20 0.65
MAPT P10636 1/20 0.46
MEN1 O00255 1/20 0.44
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
KMT2A Q03164 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
SMPD1 P17405 1/20 0.43
HDAC8 Q9BY41 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41
CTSD P07339 1/20 0.40

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
SCHEMBL7996733 0.87 MMP3 (0.49) MMP3MAPTMEN1NPC1RAB9A
SCHEMBL7990113 0.87 MMP3 (0.61) MMP3MEN1NPC1RAB9AKMT2A
SCHEMBL7990117 0.87 MMP3 (0.61) MMP3MEN1NPC1RAB9AKMT2A
SCHEMBL7991703 0.80 MMP3 (0.43) MMP3MAPTMEN1NPC1RAB9A
SCHEMBL7398298 0.79 MMP3 (1.00) MMP3MEN1KMT2A
SCHEMBL11646131 0.77 MAPT (0.62) MAPTMEN1NPC1RAB9AKMT2A
SCHEMBL7398557 0.73 MMP3 (1.00) MMP3MAPTSMPD1HDAC8HDAC6
SCHEMBL7993303 0.73 MMP3 (0.64) MMP3
SCHEMBL6391762 0.73 MAPT (0.53) MAPTNPC1RAB9AKMT2ASMN1; SMN2
SCHEMBL7389210 0.72 MMP3 (0.90) MMP3MAPTSMPD1HDAC8HDAC6

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
US-6288261-B1 DRUGS FOR INHIBITION OF ENZYMES ABBOTT LABORATORIES 2001-09-11 US claimed
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