SCHEMBL8338706

SCHEMBL8338706

COc1cc(-c2ccc(C)cc2)ccc1O

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FYN P06241 1/20 0.61
MAOB P27338 1/20 0.55
POLB P06746 1/20 0.53
GAA P10253 2/20 0.53
RECQL P46063 1/20 0.53
GFER P55789 1/20 0.53
HPGD P15428 2/20 0.53
MEN1 O00255 2/20 0.53
KMT2A Q03164 2/20 0.53
LMNA P02545 1/20 0.53
MAPT P10636 1/20 0.53
ALOX15 P16050 1/20 0.53
ALOX12 P18054 1/20 0.53
MAPK1 P28482 1/20 0.53
NPSR1 Q6W5P4 1/20 0.53
HSD17B10 Q99714 1/20 0.53
CSNK2A2 P19784 2/20 0.51
CSNK2B P67870 2/20 0.51
CSNK2A1 P68400 2/20 0.51
CXCL12 P48061 2/20 0.50

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
SCHEMBL18308826 0.93 FYN (0.56) FYNMAOBPOLBGAARECQL
SCHEMBL4386820 0.92 MAOB (0.64) FYNMAOBPOLBGAARECQL
SCHEMBL3693339 0.89 MAOB (0.67) FYNMAOBPOLBGAARECQL
SCHEMBL3813200 0.86 MAOB (0.69) MAOBPOLBGAAHPGDMEN1
SCHEMBL18121551 0.86 MAOB (0.57) FYNMAOBPOLBGAARECQL
SCHEMBL9622952 0.86 MAOB (0.69) MAOBPOLBGAAHPGDMEN1
SCHEMBL2524920 0.84 POLB (0.62) FYNMAOBPOLBGAAHPGD
SCHEMBL30957832 0.84 POLB (0.62) FYNMAOBPOLBGAAHPGD
SCHEMBL13846509 0.84 MAPT (0.49) FYNGAAHPGDMEN1KMT2A
SCHEMBL12477879 0.83 APP (0.61) FYNMAOBPOLBGAARECQL

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
WO-2004024060-A2 METALLOPROTEINASE INHIBITORS AND INTERMEDIATES FOR PREPARATION THEREOF ASTRAZENECA AB (SE) 2004-03-25 WO disclosed