SCHEMBL14645944

SCHEMBL14645944

Cc1ccc(N(c2ccc(C)cc2)c2ccc(-c3cc4c(s3)-c3sc(C=C(C#N)C(=O)O)cc3C4=O)cc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.53
APP P05067 1/20 0.44
SLC16A3 O15427 3/20 0.39
SLC16A1 P53985 3/20 0.39
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
LMNA P02545 1/20 0.33
POLB P06746 1/20 0.33
THRB P10828 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
KDM4E B2RXH2 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
SCHEMBL14646279 1.00 MAPT (0.53) MAPTAPPSLC16A3SLC16A1MEN1
SCHEMBL14646315 0.94 MAPT (0.59) MAPTAPPSLC16A3SLC16A1MEN1
SCHEMBL14646292 0.84 PTGES (0.45) MAPTAPPSLC16A3SLC16A1
SCHEMBL14645903 0.80 MAPT (0.42) MAPTAPPSLC16A3SLC16A1LMNA
SCHEMBL14773202 0.80 MAPT (0.79) MAPTAPPSLC16A3SLC16A1MEN1
SCHEMBL10058505 0.80 MAPT (0.79) MAPTAPPSLC16A3SLC16A1MEN1
SCHEMBL14646281 0.80 APP (0.41) APP
SCHEMBL11936918 0.80 MAPT (0.51) MAPTAPPSLC16A3SLC16A1MEN1
SCHEMBL7008387 0.79 MAPT (0.77) MAPTAPPSLC16A3SLC16A1MEN1
SCHEMBL14645505 0.79 MAPT (0.61) MAPTAPPSLC16A3SLC16A1MEN1

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-2013008951-A1 ORGANIC DYE, DYE-SENSITIZED METAL OXIDE SEMICONDUCTOR ELECTRODE AND DYE-SENSITIZED SOLAR CELL NATIONAL INSTITUTE FOR MATERIALS SCIENCE (JP) 2013-01-17 WO disclosed