SCHEMBL8699348

SCHEMBL8699348

CN(C)Cc1cccn1-c1cccc(C(=O)NC(=N)N)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AOC2 O75106 1/20 0.40
F10 P00742 6/20 0.37
PDGFRB P09619 1/20 0.37
PDGFRA P16234 1/20 0.37
FLT1 P17948 1/20 0.37
FLT4 P35916 1/20 0.37
KDR P35968 1/20 0.37
ROCK2 O75116 3/20 0.35
NSD2 O96028 1/20 0.34
POLB P06746 1/20 0.34
MAPT P10636 1/20 0.34
NR4A1 P22736 1/20 0.34
APEX1 P27695 1/20 0.34
MAPK1 P28482 1/20 0.34
PTPN7 P35236 1/20 0.34
RECQL P46063 1/20 0.34
HSD17B10 Q99714 1/20 0.34
CTDSP1 Q9GZU7 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
L3MBTL1 Q9Y468 1/20 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
Hydrochloric Acid SCHEMBL8700025 0.99 AOC2 (0.40) AOC2F10PDGFRBPDGFRAFLT1
Hydrochloric Acid SCHEMBL8705820 0.80 AOC2 (0.42) AOC2F10ROCK2NSD2POLB
SCHEMBL8699862 0.80 AOC2 (0.42) AOC2F10ROCK2NSD2POLB
SCHEMBL7825574 0.80 PDGFRB (0.52) PDGFRBPDGFRAFLT1FLT4KDR
SCHEMBL8700313 0.79 AOC2 (0.43) AOC2F10ROCK2NSD2POLB
SCHEMBL7827587 0.79 PDGFRB (0.38) PDGFRBPDGFRAFLT1FLT4KDR
Hydrochloric Acid SCHEMBL8701063 0.79 AOC2 (0.41) AOC2F10ROCK2NSD2POLB
Hydrochloric Acid SCHEMBL8699397 0.78 AOC2 (0.43) AOC2F10ROCK2NSD2POLB
Hydrochloric Acid SCHEMBL7823645 0.78 PDGFRB (0.38) PDGFRBPDGFRAFLT1FLT4KDR
Hydrochloric Acid SCHEMBL8699440 0.77 PLA2G10 (0.35) AOC2F10ROCK2POLBMAPT

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-5824691-A CARDIOVASCULAR, CEREBROVASCULAR, RENAL DISEASES; SHOCK, ARTERIOSCLEROSIS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1998-10-20 US disclosed