SCHEMBL11567361

SCHEMBL11567361

C=CCN(CC)C(=O)n1cnc(S(=O)(=O)N(C)c2ccc(F)cc2)n1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 1/20 0.45
SMN1; SMN2 Q16637 3/20 0.37
NPSR1 Q6W5P4 1/20 0.35
LMNA P02545 1/20 0.35
MAPT P10636 3/20 0.34
TDP1 Q9NUW8 1/20 0.33
KMT2A Q03164 2/20 0.33
MEN1 O00255 1/20 0.33
ITGB1 P05556 1/20 0.32
ITGA2 P17301 1/20 0.32
LSS P48449 2/20 0.32
FFAR1 O14842 1/20 0.32
PTGDR2 Q9Y5Y4 1/20 0.32
HTT P42858 1/20 0.31

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
SCHEMBL11585145 0.96 DPP4 (0.48) DPP4SMN1; SMN2NPSR1LMNAMAPT
SCHEMBL11557261 0.93 DPP4 (0.43) DPP4SMN1; SMN2NPSR1LMNAMAPT
SCHEMBL11558337 0.91 DPP4 (0.43) DPP4SMN1; SMN2NPSR1LMNAMAPT
SCHEMBL11564013 0.90 DPP4 (0.40) DPP4SMN1; SMN2NPSR1LMNAMAPT
SCHEMBL11565348 0.86 TDP1 (0.37) DPP4SMN1; SMN2NPSR1MAPTTDP1
SCHEMBL11561717 0.84 CNR2 (0.36) NPSR1LMNAMAPTTDP1ITGB1
SCHEMBL11562507 0.84 CNR2 (0.40) SMN1; SMN2NPSR1MAPTTDP1KMT2A
SCHEMBL11564860 0.84 DPP4 (0.52) DPP4MAPTKMT2AMEN1
SCHEMBL11563637 0.82 DPP4 (0.51) DPP4MAPT
SCHEMBL11560668 0.81 DPP4 (0.52) DPP4LMNAMAPTTDP1KMT2A

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-4148626-A Herbicidal agents THE BOOTS COMPANY LIMITED (GB) 1979-04-10 US disclosed