SCHEMBL2498832

SCHEMBL2498832

CC(C)(C)N=Cc1ccccc1O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 6/20 0.53
CA2 P00918 6/20 0.53
CA9 Q16790 5/20 0.53
KDM4E B2RXH2 2/20 0.53
SIRT2 Q8IXJ6 1/20 0.53
MEN1 O00255 4/20 0.50
KMT2A Q03164 4/20 0.50
RAB9A P51151 3/20 0.50
MAPT P10636 3/20 0.50
NPC1 O15118 2/20 0.50
ALDH1A1 P00352 2/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
GAA P10253 2/20 0.47
CTRC Q99895 1/20 0.47
DUSP3 P51452 1/20 0.47
PTPN5 P54829 1/20 0.47
PTPN11 Q06124 1/20 0.47
HPGD P15428 1/20 0.47
GFER P55789 1/20 0.47
L3MBTL1 Q9Y468 2/20 0.46

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
SCHEMBL19840166 1.00 CA12 (0.53) CA12CA2CA9KDM4ESIRT2
SCHEMBL14011732 1.00 CA12 (0.53) CA12CA2CA9KDM4ESIRT2
SCHEMBL9482973 0.88 CA12 (0.53) CA12CA2CA9KDM4ESIRT2
SCHEMBL30125580 0.81 CA12 (0.52) CA12CA2CA9KDM4ESIRT2
SCHEMBL16905115 0.81 CA12 (0.52) CA12CA2CA9KDM4ESIRT2
SCHEMBL23425295 0.81 CA12 (0.52) CA12CA2CA9KDM4ESIRT2
SCHEMBL14992772 0.81 TRIM24 (0.48) CA12CA2CA9KDM4ESIRT2
SCHEMBL23425297 0.81 CA12 (0.52) CA12CA2CA9KDM4ESIRT2
SCHEMBL28609605 0.81 CA12 (0.47) CA12CA2CA9KDM4ESIRT2
SCHEMBL12770958 0.81 MAPT (0.42) CA12CA2CA9KDM4ESIRT2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8030382-B2 Polylactic acid composition TEIJIN LIMITED (JP) 2011-10-04 US disclosed
US-20100093888-A1 POLYLACTIC ACID COMPOSITION TEIJIN LIMITED (JP) 2010-04-15 US disclosed
EP-2116576-A1 POLYLACTIC ACID COMPOSITION Teijin Limited (JP) 2009-11-11 EP disclosed
US-6498180-B1 SUCH AS 2-(3'-HYDROXYMETHYL-2'-CARBOXYCYCLOPROPYL)GLYCINE; MODULATING METABOTROPIC GLUTAMATE RECEPTOR; TREATING DISORDERS OF CENTRAL NERVOUS ELI LILLY AND COMPANY 2002-12-24 US disclosed
EP-1189873-A1 EXCITATORY AMINO ACID RECEPTOR MODULATORS Lilly, S.A. (ES) 2002-03-27 EP disclosed
WO-2000075101-A1 EXCITATORY AMINO ACID RECEPTOR MODULATORS LILLY, S.A. (ES) 2000-12-14 WO disclosed