SCHEMBL21603880

SCHEMBL21603880

CCOC(=O)C1CCCc2c1sc(NC(=O)C1CC1CCOC(=O)C1CCc3sc(NC(=O)C4CC4)c(C(=O)NCC4CC4)c3C1)c2C(=O)NCC1CC1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 7/20 0.41
CNR1 P21554 2/20 0.41
MAPT P10636 5/20 0.36
HTT P42858 1/20 0.36
KDM4E B2RXH2 3/20 0.36
HSD17B10 Q99714 1/20 0.36
FLT3 P36888 1/20 0.35
KMT2A Q03164 1/20 0.35
ALDH1A1 P00352 3/20 0.34
LMNA P02545 1/20 0.34
POLB P06746 2/20 0.33
TDP1 Q9NUW8 1/20 0.33
GAA P10253 1/20 0.32
HPGD P15428 1/20 0.32
MAPK1 P28482 1/20 0.32
REV1 Q9UBZ9 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
SCHEMBL21597774 0.84 CNR2 (0.45) CNR2CNR1MAPTHTTKDM4E
SCHEMBL21597174 0.84 CNR2 (0.48) CNR2CNR1MAPTHTTKDM4E
SCHEMBL21597625 0.76 CNR2 (0.46) CNR2CNR1MAPTKDM4EHSD17B10
SCHEMBL21604195 0.74 CNR2 (0.45) CNR2CNR1MAPTKDM4EHSD17B10
SCHEMBL21597165 0.74 CNR2 (0.45) CNR2CNR1MAPTKDM4EHSD17B10
SCHEMBL21603675 0.73 CNR2 (0.52) CNR2CNR1MAPTKDM4EHSD17B10
SCHEMBL21603709 0.73 CNR2 (0.48) CNR2CNR1MAPTKDM4EHSD17B10
SCHEMBL21597670 0.72 MAPT (0.47) CNR2CNR1MAPTHTTKDM4E
SCHEMBL21597806 0.72 CNR2 (0.46) CNR2CNR1MAPTKDM4EHSD17B10
SCHEMBL28920828 0.71 CNR2 (0.50) CNR2CNR1MAPTKDM4EHSD17B10

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-2019243550-A1 THIOPHENE DERIVATIVES FOR THE TREATMENT OF DISORDERS CAUSED BY IGE UCB Biopharma SRL (BE) 2019-12-26 WO disclosed