SCHEMBL26635296

SCHEMBL26635296

N#Cc1ccc(-c2ccc(Cl)cc2C=O)cn1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
XDH P47989 1/20 0.47
ERN1 O75460 2/20 0.41
VHL P40337 1/20 0.40
PDE10A Q9Y233 1/20 0.38
CHEK1 O14757 3/20 0.38
MALT1 Q9UDY8 1/20 0.37
USP8 P40818 2/20 0.37
USP7 Q93009 2/20 0.37
TDP1 Q9NUW8 1/20 0.37
TNF P01375 1/20 0.35
AURKA O14965 1/20 0.35
CDK2 P24941 1/20 0.35
FLT4 P35916 1/20 0.35
FLT3 P36888 1/20 0.35
MAPKAPK2 P49137 1/20 0.35
GSK3A P49840 1/20 0.35
GSK3B P49841 1/20 0.35
RPS6KA3 P51812 1/20 0.35
MAPK12 P53778 1/20 0.35
CDK5 Q00535 1/20 0.35

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
SCHEMBL30540161 1.00 XDH (0.47) XDHERN1VHLPDE10ACHEK1
SCHEMBL26635169 0.83 XDH (0.46) XDHERN1USP8USP7TDP1
SCHEMBL610902 0.80 XDH (0.42) XDHVHLPDE10ACHEK1TDP1
SCHEMBL30540164 0.80 ALDH1A1 (0.51) XDHERN1USP8USP7TDP1
SCHEMBL26635456 0.80 ALDH1A1 (0.51) XDHERN1USP8USP7TDP1
SCHEMBL30540273 0.78 USP8 (0.44) XDHERN1USP8USP7TDP1
SCHEMBL26635484 0.78 USP8 (0.44) XDHERN1USP8USP7TDP1
SCHEMBL26635345 0.78 XDH (0.52) XDHERN1USP8USP7TDP1
SCHEMBL30540283 0.77 USP8 (0.43) XDHERN1USP8USP7TDP1
SCHEMBL26635189 0.77 USP8 (0.43) XDHERN1USP8USP7TDP1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023208151-A1 USP INHIBITOR, PREPARATION METHOD THEREFOR, AND APPLICATION 北京华森英诺生物科技有限公司 2023-11-02 WO disclosed
CN-116621778-A USP inhibitor, preparation method and application thereof 北京华森英诺生物科技有限公司 2023-08-22 CN disclosed