SCHEMBL14646285

SCHEMBL14646285

CCCCCCCCOc1ccc(N(c2ccc(OC)cc2)c2ccc(-c3cc4c(s3)-c3sc(-c5ccc(/C=C(\C#N)C(=O)O)s5)cc3C4=O)cc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.51
APP P05067 2/20 0.45
PTGES O14684 1/20 0.42
SLC16A3 O15427 4/20 0.41
SLC16A1 P53985 4/20 0.41
ATM Q13315 1/20 0.34
ALDH1A1 P00352 1/20 0.34
RARB P10826 3/20 0.34

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
SCHEMBL14646292 0.90 PTGES (0.45) MAPTAPPPTGESSLC16A3SLC16A1
SCHEMBL14769757 0.86 MAPT (0.68) MAPTAPPPTGESSLC16A3SLC16A1
SCHEMBL14645954 0.85 MAPT (0.49) MAPTAPPPTGESSLC16A3SLC16A1
SCHEMBL31713031 0.85 MAPT (0.67) MAPTAPPPTGESSLC16A3SLC16A1
SCHEMBL15859194 0.81 MAPT (0.56) MAPTAPPPTGESALDH1A1RARB
SCHEMBL15859196 0.81 MAPT (0.56) MAPTAPPPTGESALDH1A1RARB
SCHEMBL23100519 0.80 MAPT (0.55) MAPTAPPPTGESSLC16A3SLC16A1
SCHEMBL7006862 0.80 MAPT (0.78) MAPTAPPSLC16A3SLC16A1ATM
SCHEMBL14330270 0.79 MAPT (0.59) MAPTAPPPTGESSLC16A3SLC16A1
SCHEMBL16982633 0.79 MAPT (0.48) MAPTAPPPTGESSLC16A3SLC16A1

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