SCHEMBL20179446

SCHEMBL20179446

Cn1c(O)c(C(=O)Nc2ccc(-c3c[nH][nH]3)cc2)c(=O)n(C)c1=O

nearest known ligand 0.62

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
XDH P47989 6/20 0.62
MAPT P10636 5/20 0.43
LMNA P02545 3/20 0.43
HSD17B10 Q99714 1/20 0.43
ALDH1A1 P00352 4/20 0.41
GAA P10253 3/20 0.41
HPGD P15428 1/20 0.41
KMT2A Q03164 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
KDM4E B2RXH2 1/20 0.40
SLC22A12 Q96S37 1/20 0.40
MEN1 O00255 1/20 0.40
TDP1 Q9NUW8 1/20 0.38
HTT P42858 1/20 0.38
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37

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
SCHEMBL22381452 0.82 XDH (0.65) XDHMAPTLMNAHSD17B10ALDH1A1
SCHEMBL22364269 0.79 XDH (0.67) XDHMAPTLMNAHSD17B10ALDH1A1
SCHEMBL8941729 0.73 XDH (0.54) XDHMAPTLMNAHSD17B10KMT2A
SCHEMBL29390286 0.73 XDH (0.54) XDHMAPTLMNAHSD17B10KMT2A
SCHEMBL24222108 0.73 XDH (0.53) XDHKMT2ASLC22A12MEN1NPC1
SCHEMBL20179667 0.71 XDH (0.39) XDHSMN1; SMN2SLC22A12
SCHEMBL22364248 0.71 XDH (0.54) XDHMAPTLMNAHSD17B10ALDH1A1
SCHEMBL20179600 0.71 XDH (0.73) XDHMAPTLMNAHSD17B10ALDH1A1
SCHEMBL22381443 0.65 XDH (0.49) XDHSLC22A12
SCHEMBL24222220 0.62 XDH (0.45) XDHMAPTALDH1A1GAAHPGD

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-2018005192-A9 COMPOUNDS AND THEIR USE FOR REDUCING URIC ACID LEVELS ACQUIST LLC (US) 2018-05-24 WO disclosed