SCHEMBL7158409

SCHEMBL7158409

CNc1nc2c(C)c(C(=O)Oc3ccnn3C)ccc2s1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.38
NPC1 O15118 3/20 0.37
RAB9A P51151 2/20 0.37
GAA P10253 3/20 0.36
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
ATM Q13315 1/20 0.35
LMNA P02545 4/20 0.33
ALDH1A1 P00352 3/20 0.33
KDM4E B2RXH2 2/20 0.33
TP53 P04637 1/20 0.33
RECQL P46063 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
DYRK1A Q13627 1/20 0.33
HPGD P15428 2/20 0.32
MAPK1 P28482 1/20 0.32
CHRM4 P08173 1/20 0.32
ADORA3 P0DMS8 1/20 0.32

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
SCHEMBL7154413 0.77 KDM4E (0.32) MEN1KMT2AALDH1A1KDM4EHPGD
SCHEMBL7159408 0.77 ALDH1A1 (0.34) MAPTALDH1A1KDM4EHPGD
SCHEMBL6979290 0.74 MAPT (0.49) MAPTNPC1RAB9AGAAMEN1
SCHEMBL7088309 0.73 MAPT (0.39) MAPTNPC1RAB9AGAAMEN1
SCHEMBL6979296 0.69 MAPT (0.46) MAPTNPC1RAB9AGAAMEN1
SCHEMBL12602534 0.69 SMN1; SMN2 (0.32) GAAALDH1A1NPSR1
SCHEMBL7156589 0.66
SCHEMBL6476488 0.66 MAPT (0.46) MAPTNPC1RAB9AMEN1KMT2A
SCHEMBL30293897 0.65 NAMPT (0.44) MAPTNPC1RAB9AGAAATM
SCHEMBL10959724 0.64 MAPT (0.53) MAPTNPC1RAB9AGAAKMT2A

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-6541423-B1 Controlling vegatation BASF AKTIENGESELLSCHAFT (DE) 2003-04-01 US disclosed