SCHEMBL17809388

SCHEMBL17809388

c1ccc(-c2cc(-n3c4ccccc4c4cc5c(cc43)c3ccccc3n5-c3cccc4c3sc3ccccc34)nc(-c3ccccc3)n2)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.38
TSHR P16473 1/20 0.38
MAPK1 P28482 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
HSD17B10 Q99714 1/20 0.38
HPGD P15428 3/20 0.37
TNKS O95271 1/20 0.33
TNKS2 Q9H2K2 1/20 0.33
ALOX5 P09917 1/20 0.33
ADORA2A P29274 1/20 0.32
ADORA1 P30542 1/20 0.32
MEN1 O00255 3/20 0.31
KMT2A Q03164 3/20 0.31
ALDH1A1 P00352 2/20 0.31
NTSR1 P30989 1/20 0.31
PRKDC P78527 2/20 0.31
HTT P42858 1/20 0.30
KDM4E B2RXH2 1/20 0.30
LMNA P02545 1/20 0.30
GLA P06280 1/20 0.30

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
SCHEMBL17809327 0.97 MAPT (0.37) MAPTTSHRMAPK1NPSR1HSD17B10
SCHEMBL23805711 0.91 MAPT (0.37) MAPTTSHRMAPK1NPSR1HSD17B10
SCHEMBL17809253 0.90 MAPT (0.38) MAPTTSHRMAPK1NPSR1HSD17B10
SCHEMBL17809333 0.89 MAPT (0.36) MAPTTSHRMAPK1NPSR1HSD17B10
SCHEMBL17809264 0.88 MAPT (0.37) MAPTTSHRMAPK1NPSR1HSD17B10
SCHEMBL17809258 0.88 MAPT (0.37) MAPTTSHRMAPK1NPSR1HSD17B10
SCHEMBL18553410 0.88 MAPT (0.38) MAPTTSHRMAPK1NPSR1HSD17B10
SCHEMBL20988531 0.87 TNKS (0.36) MAPTTNKSTNKS2ALOX5ADORA2A
SCHEMBL21734519 0.87 ALOX5 (0.45) MAPTTSHRMAPK1NPSR1HSD17B10
SCHEMBL10014632 0.86 MAPT (0.41) MAPTTSHRMAPK1NPSR1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160163995-A1 ORGANIC OPTOELECTRIC DEVICE AND DISPLAY DEVICE SAMSUNG SDI CO., LTD. (KR) 2016-06-09 US disclosed
US-20160163995-A1 ORGANIC OPTOELECTRIC DEVICE AND DISPLAY DEVICE SAMSUNG SDI CO., LTD. (KR) 2016-06-09 US disclosed