SCHEMBL22792158

SCHEMBL22792158

SCc1cnn2cccnc12

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SMPD3 Q9NY59 3/20 0.55
AXL P30530 1/20 0.55
CDK2 P24941 1/20 0.50
BMP4 P12644 1/20 0.42
HSD17B10 Q99714 3/20 0.40
KDM4E B2RXH2 3/20 0.40
PKM P14618 1/20 0.40
CSF1R P07333 1/20 0.39
JAK1 P23458 1/20 0.39
PIK3C3 Q8NEB9 1/20 0.39
HPGD P15428 2/20 0.38
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.38
HTT P42858 1/20 0.38
MAPT P10636 1/20 0.37
PDE10A Q9Y233 1/20 0.37
IRAK4 Q9NWZ3 4/20 0.37
NPSR1 Q6W5P4 1/20 0.37
HSD11B1 P28845 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
SCHEMBL805457 0.81 SMPD3 (0.55) SMPD3AXLCDK2BMP4HSD17B10
SCHEMBL30579408 0.81 SMPD3 (0.55) SMPD3AXLCDK2BMP4HSD17B10
SCHEMBL22792265 0.77 SMPD3 (0.50) SMPD3AXLCDK2BMP4HSD17B10
SCHEMBL1243349 0.75 SMPD3 (0.51) SMPD3AXLCDK2BMP4HSD17B10
SCHEMBL30579401 0.75 SMPD3 (0.47) SMPD3AXLCDK2BMP4HSD17B10
SCHEMBL29518379 0.75 SMPD3 (0.51) SMPD3AXLCDK2HSD17B10KDM4E
SCHEMBL9461961 0.73 CSF1R (0.49) SMPD3AXLCDK2BMP4HSD17B10
SCHEMBL5791049 0.71 SMPD3 (1.00) SMPD3AXLCDK2BMP4JAK1
SCHEMBL84781 0.71 SMPD3 (0.60) SMPD3AXLCDK2BMP4HSD17B10
SCHEMBL1693808 0.71 AXL (1.00) SMPD3AXLCDK2BMP4JAK1

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-2020252229-A2 INHIBITORS OF SARM1 DISARM THERAPEUTICS, INC. (US) 2020-12-17 WO disclosed