SCHEMBL15085176

SCHEMBL15085176

COc1ccc(-n2c(-c3ccccc3)c(-c3ccc(-c4ccc(/C=C(/C#N)C(=O)O)s4)s3)c3ccccc32)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.48
APP P05067 2/20 0.44
KMT2A Q03164 6/20 0.40
MEN1 O00255 4/20 0.40
ALDH1A1 P00352 6/20 0.38
TSHR P16473 1/20 0.38
EDNRA P25101 1/20 0.38
KDM4E B2RXH2 2/20 0.37
LMNA P02545 1/20 0.37
PKM P14618 1/20 0.37
ABCB1 P08183 1/20 0.36
SLC16A1 P53985 1/20 0.36
THRB P10828 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
HPGD P15428 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
PADI4 Q9UM07 1/20 0.35
CRHBP P24387 1/20 0.35
CRHR2 Q13324 1/20 0.35

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
SCHEMBL15085180 1.00 MAPT (0.48) MAPTAPPKMT2AMEN1ALDH1A1
SCHEMBL15085177 0.88 MEN1 (0.41) MAPTKMT2AMEN1ALDH1A1EDNRA
SCHEMBL16656576 0.83 ALDH1A1 (0.40) MAPTAPPKMT2AMEN1ALDH1A1
SCHEMBL15085181 0.83 ALDH1A1 (0.40) MAPTAPPKMT2AMEN1ALDH1A1
SCHEMBL11941728 0.80 MAPT (0.66) MAPTAPPKMT2AMEN1ALDH1A1
SCHEMBL16656580 0.79 MEN1 (0.34) MAPTAPPKMT2AMEN1ALDH1A1
SCHEMBL10315287 0.78 MAPT (0.62) MAPTAPPKMT2AMEN1ALDH1A1
SCHEMBL15085215 0.78 MAPT (0.41) MAPTAPPKMT2AMEN1ALDH1A1
SCHEMBL15082767 0.77 MAPT (0.34) MAPTAPPALDH1A1KDM4ELMNA
SCHEMBL12294167 0.77 MAPT (0.59) MAPTAPPKMT2AMEN1ALDH1A1

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-20130167932-A1 INDOLE COMPOUND, AND PHOTOELECTRIC CONVERSION DYE USING SAME, SEMICONDUCTOR ELECTRODE, PHOTOELECTRIC CONVERSION ELEMENT, AND PHOTOELECTROCHEMICAL CELL NEC CORPORATION (JP) 2013-07-04 US disclosed