SCHEMBL7593135

SCHEMBL7593135

CC(=O)Cl.NCCCC[C@H](NC(c1ccccc1)(c1ccccc1)c1ccccc1)C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MMP9 P14780 2/20 0.47
MMP2 P08253 1/20 0.47
TLR2 O60603 2/20 0.42
FOLH1 Q04609 1/20 0.40
CPB2 Q96IY4 3/20 0.39
MMP1 P03956 2/20 0.39
MMP3 P08254 2/20 0.39
ERAP2 Q6P179 1/20 0.39
LNPEP Q9UIQ6 1/20 0.39
CPA1 P15085 1/20 0.39
CPA2 P48052 1/20 0.39
CPA4 Q9UI42 1/20 0.39
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
ANPEP P15144 1/20 0.38
PYGL P06737 1/20 0.38
CPB1 P15086 1/20 0.37

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
SCHEMBL29422004 0.93 MMP2 (0.52) MMP9MMP2TLR2FOLH1CPB2
SCHEMBL1268928 0.88 KIF11 (0.47) MMP9MMP2TLR2FOLH1CA1
SCHEMBL7603846 0.85 KIF11 (0.50) MMP9MMP2TLR2CPB2ANPEP
SCHEMBL17274480 0.85 KIF11 (0.50) MMP9MMP2TLR2CPB2ANPEP
SCHEMBL22634192 0.84 KIF11 (0.48) MMP9MMP2TLR2
SCHEMBL367485 0.84 KIF11 (0.48) MMP9MMP2TLR2
SCHEMBL367484 0.84 KIF11 (0.48) MMP9MMP2TLR2
SCHEMBL25184422 0.84 MMP2 (0.44) MMP9MMP2TLR2FOLH1CPB2
SCHEMBL20191077 0.81 MMP2 (0.42) MMP9MMP2TLR2FOLH1CPB2
SCHEMBL3607588 0.80 MME (0.47) MMP2MMP3CPA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020086009-A1 ANTI-PHOSPHORYLATED TAU PROTEIN ANTIBODIES AND METHODS FOR DETECTING ALZHEIMER`S DISEASE WITH THE USE OF THE SAME MITSUBISHI CHEMICAL CORPORATION (JP) 2002-07-04 US disclosed