SCHEMBL6015972

SCHEMBL6015972

CC(O)OCn1cc(C=O)c2cccnc21

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 3/20 0.40
SNCA P37840 3/20 0.40
NPC1 O15118 3/20 0.39
RAB9A P51151 3/20 0.39
KMT2A Q03164 2/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
KDM4E B2RXH2 1/20 0.39
MEN1 O00255 1/20 0.39
HSP90AA1 P07900 1/20 0.39
IDO1 P14902 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
ALDH1A1 P00352 3/20 0.38
POLB P06746 2/20 0.37
CFD P00746 1/20 0.37
TDP1 Q9NUW8 1/20 0.36
PDE4A P27815 1/20 0.36
KCNH2 Q12809 1/20 0.36
CNR1 P21554 1/20 0.36
CNR2 P34972 1/20 0.36
MAPT P10636 2/20 0.36

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
SCHEMBL6015684 0.81 APP (0.39) APPSNCANPC1RAB9AALDH1A1
SCHEMBL15546774 0.77 POLB (0.39) APPSNCANPC1RAB9AKMT2A
SCHEMBL7619956 0.76 KMT2A (0.40) APPSNCANPC1RAB9AKMT2A
SCHEMBL31516345 0.76 CNR1 (0.44) APPSNCANPC1RAB9AKMT2A
SCHEMBL89569 0.73 GSK3B (0.53) NPC1RAB9AL3MBTL1ALDH1A1POLB
SCHEMBL19410208 0.73 ALDH1A1 (0.46) APPSNCANPC1RAB9AKMT2A
SCHEMBL6090127 0.73 CNR2 (0.50) APPSNCANPC1RAB9AKMT2A
SCHEMBL12252047 0.72 APP (0.65) APPSNCAKMT2AL3MBTL1MEN1
SCHEMBL6087986 0.71 CNR1 (0.44) NPC1RAB9AALDH1A1CNR1CNR2
SCHEMBL413483 0.70 KMT2A (0.41) APPSNCANPC1RAB9AKMT2A

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-7049312-B1 Benzothiazinone and benzoxazinone compounds ABBOTT GMBH & CO. KG (DE) 2006-05-23 US disclosed