SCHEMBL20179667

SCHEMBL20179667

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

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
XDH P47989 10/20 0.39
SLC22A12 Q96S37 5/20 0.36
ADORA2B P29275 3/20 0.32
ADORA3 P0DMS8 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.31
PKM P14618 1/20 0.30
ADORA2A P29274 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
SCHEMBL22381451 0.82 XDH (0.43) XDHSLC22A12
SCHEMBL22381450 0.80 XDH (0.43) XDHSLC22A12ADORA2B
SCHEMBL20179456 0.78 XDH (0.55) XDHSLC22A12
SCHEMBL20179446 0.71 XDH (0.62) XDHSLC22A12SMN1; SMN2
SCHEMBL22381443 0.70 XDH (0.49) XDHSLC22A12
SCHEMBL20179600 0.67 XDH (0.73) XDHSLC22A12
SCHEMBL22364248 0.65 XDH (0.54) XDHSMN1; SMN2
SCHEMBL24222220 0.63 XDH (0.45) XDH
SCHEMBL22381453 0.60 XDH (0.54) XDHSLC22A12
SCHEMBL22364231 0.58 XDH (0.54) XDHSLC22A12

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