SCHEMBL29953852

SCHEMBL29953852

OB(O)c1c[nH]c2cc(-c3ccccc3)cnc12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AXL P30530 7/20 0.43
CDK8 P49336 2/20 0.43
KDM4E B2RXH2 1/20 0.42
GSK3B P49841 2/20 0.41
TNIK Q9UKE5 1/20 0.41
PLK4 O00444 1/20 0.41
CHEK1 O14757 1/20 0.41
PRKD3 O94806 1/20 0.41
MAP4K4 O95819 1/20 0.41
CDK1 P06493 1/20 0.41
LYN P07948 1/20 0.41
RET P07949 1/20 0.41
PIM1 P11309 1/20 0.41
FER P16591 1/20 0.41
CDK2 P24941 1/20 0.41
MARK3 P27448 1/20 0.41
FLT4 P35916 1/20 0.41
KDR P35968 1/20 0.41
FLT3 P36888 1/20 0.41
SYK P43405 1/20 0.41

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
SCHEMBL28523488 0.76 AXL (0.44) AXLCDK8KDM4EGSK3BTNIK
SCHEMBL18363126 0.76 CDK8 (0.44) AXLCDK8KDM4EGSK3BTNIK
SCHEMBL29958035 0.72 JAK2 (0.44) AXLCDK8TNIKPLK4PRKD3
SCHEMBL29951554 0.71 MAP4K1 (0.39) KDM4EPIM1PIM3CLK4MKNK2
SCHEMBL29953859 0.70 PSMD14 (0.44) KDM4EGSK3BPRKD3KDRFLT3
SCHEMBL29954554 0.69 ALDH1A1 (0.51) AXLCDK8KDM4EGSK3BTNIK
SCHEMBL29954564 0.67 MAPT (0.61) AXLKDM4EAURKB
SCHEMBL24659982 0.64 KDM4E (0.49) AXLCDK8KDM4EGSK3BTNIK
SCHEMBL23098900 0.64 MGLL (0.50) KDM4E
SCHEMBL31665907 0.64 PIK3CD (0.54) AXLCDK8KDM4EGSK3BTNIK

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-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed