SCHEMBL21242073

SCHEMBL21242073

CN(C)Sc1cccc(C(=O)NCC(=O)Nc2nc(C3CCCCC3)cs2)c1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
RORC P51449 1/20 0.46
TMIGD3 P0DMS9 3/20 0.39
ADORA1 P30542 3/20 0.39
ADORA2A P29274 1/20 0.39
ADCY1 Q08828 1/20 0.39
PDE5A O76074 2/20 0.38
CSNK1D P48730 1/20 0.38
PDE1A P54750 1/20 0.38
PDE1B Q01064 1/20 0.38
PDE1C Q14123 1/20 0.38
POLB P06746 1/20 0.38
MAPT P10636 1/20 0.37
TRPA1 O75762 1/20 0.36
GCK P35557 1/20 0.36
CCR2 P41597 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.35
IDO1 P14902 1/20 0.35
NPC1 O15118 1/20 0.35
USP2 O75604 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
SCHEMBL21225297 0.83 RORC (0.51) RORCMAPTNPC1USP2
SCHEMBL21241931 0.82 MAPT (0.55) MAPTNPC1USP2
SCHEMBL21241888 0.81 MAPT (0.40) PDE5ACSNK1DPDE1APDE1BPDE1C
SCHEMBL21241803 0.81 CSNK2A2 (0.41) PDE5ACSNK1DPDE1APDE1BPDE1C
SCHEMBL21241981 0.80 ADORA3 (0.54) POLBMAPTL3MBTL1
SCHEMBL21241854 0.80 MAPT (0.48) MAPTNPC1
SCHEMBL21242061 0.80 POLB (0.52) POLBMAPTL3MBTL1NPC1USP2
SCHEMBL21241887 0.80 SIRT5 (0.41) CSNK1DPOLBMAPT
SCHEMBL21241789 0.80 MAPT (0.47) POLBMAPTL3MBTL1NPC1
SCHEMBL21241795 0.79 MAPT (0.45) POLBMAPTNPC1

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-2019152437-A1 COMPOUNDS AND USES THEREOF FOGHORN THERAPEUTICS INC. (US) 2019-08-08 WO disclosed