SCHEMBL13166359

SCHEMBL13166359

Nc1cc2scnc2cc1S

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 1/20 0.42
ALDH1A1 P00352 1/20 0.38
HSD17B10 Q99714 1/20 0.38
NPC1 O15118 9/20 0.37
RAB9A P51151 9/20 0.37
KDM4E B2RXH2 1/20 0.37
HKDC1 Q2TB90 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
MEN1 O00255 7/20 0.33
KMT2A Q03164 7/20 0.33
POLB P06746 1/20 0.33
GFER P55789 1/20 0.33
HSD11B1 P28845 1/20 0.32
VRK1 Q99986 1/20 0.31
HIF1A Q16665 1/20 0.30
NAMPT P43490 2/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
DAO P14920 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
SCHEMBL15689087 0.76 DYRK1A (0.42) DYRK1AALDH1A1HSD17B10NPC1RAB9A
SCHEMBL22304452 0.76 DYRK1A (0.42) DYRK1AALDH1A1HSD17B10NPC1RAB9A
SCHEMBL21155441 0.76 DYRK1A (0.42) DYRK1AALDH1A1HSD17B10NPC1RAB9A
SCHEMBL4296143 0.75 ALDH1A1 (0.52) DYRK1AALDH1A1HSD17B10NPC1RAB9A
SCHEMBL1420652 0.73 GAA (0.44) DYRK1AALDH1A1HSD17B10NPC1RAB9A
SCHEMBL4560336 0.73 ALDH1A1 (0.50) DYRK1AALDH1A1HSD17B10NPC1RAB9A
SCHEMBL22655616 0.72 MEN1 (0.48) DYRK1AALDH1A1HSD17B10NPC1RAB9A
SCHEMBL19988679 0.72 DYRK1A (0.42) DYRK1AALDH1A1HSD17B10NPC1RAB9A
SCHEMBL22120595 0.72 DYRK1A (0.42) DYRK1AALDH1A1HSD17B10NPC1RAB9A
SCHEMBL2999828 0.72 TERT (0.45) DYRK1AALDH1A1HSD17B10NPC1RAB9A

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-7790831-B1 Hyperbranched polybenzazoles via an A3+ B2 polymerization THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE AIR FORCE (US) 2010-09-07 US disclosed
US-7790831-B1 Hyperbranched polybenzazoles via an A3+ B2 polymerization THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE AIR FORCE (US) 2010-09-07 US disclosed