SCHEMBL16441964

SCHEMBL16441964

Cc1cccc(-c2cnc3sc4nc5ccccc5n4c3c2)c1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.45
HSD17B10 Q99714 1/20 0.45
TP53 P04637 5/20 0.43
MAPT P10636 2/20 0.42
GRIN2B Q13224 9/20 0.41
GRIN1 Q05586 3/20 0.41
RXFP1 Q9HBX9 1/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
MAP4K4 O95819 1/20 0.38
CSNK1G2 P78368 1/20 0.38
CLK4 Q9HAZ1 1/20 0.38
MKNK2 Q9HBH9 1/20 0.38
MAP4K5 Q9Y4K4 1/20 0.38

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
SCHEMBL16441961 0.82 HSD17B10 (0.46) KDM4EHSD17B10TP53MAPTGRIN2B
SCHEMBL16441913 0.81 TP53 (0.44) KDM4EHSD17B10TP53MAPTRXFP1
SCHEMBL16441960 0.80 KDM4E (0.44) KDM4EHSD17B10TP53MAPTNPC1
SCHEMBL16441920 0.76 HSD17B10 (0.52) KDM4EHSD17B10TP53MAPTNPC1
SCHEMBL16441938 0.73 SMN1; SMN2 (0.43) KDM4EHSD17B10TP53MAPTNPC1
SCHEMBL16441947 0.71 SMN1; SMN2 (0.47) KDM4EHSD17B10TP53MAPTNPC1
SCHEMBL20929361 0.71 HSD17B10 (0.49) KDM4EHSD17B10TP53MAPTNPC1
SCHEMBL23504077 0.70 HSD17B10 (0.59) KDM4EHSD17B10TP53MAPTNPC1
SCHEMBL16441934 0.70 HSD17B10 (0.43) KDM4EHSD17B10TP53MAPTNPC1
SCHEMBL16441887 0.70 RAB9A (0.55) KDM4EHSD17B10TP53MAPTNPC1

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-2015014791-A1 BENZIMIDAZOLO[2,1-B][1,3]BENZOTHIAZOLES FOR ELECTRONIC APPLICATIONS BASF SE (DE) 2015-02-05 WO disclosed