SCHEMBL28944256

SCHEMBL28944256

CCCCCCN1C=CC(C)=CC1.FC(F)F.N=S

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 3/20 0.33
PTGS2 P35354 3/20 0.33
MGLL Q99685 2/20 0.33
FAAH O00519 1/20 0.33
GRM2 Q14416 1/20 0.32
NPC1 O15118 6/20 0.30
RAB9A P51151 6/20 0.30
HTT P42858 4/20 0.30
GALR3 O60755 2/20 0.30
POLB P06746 2/20 0.30
ATM Q13315 2/20 0.30
MAPK1 P28482 2/20 0.30
NPSR1 Q6W5P4 2/20 0.30
LMNA P02545 2/20 0.30
SMN1; SMN2 Q16637 2/20 0.30
KDM4E B2RXH2 1/20 0.30
HSP90AA1 P07900 1/20 0.30
MAPT P10636 1/20 0.30
RAD52 P43351 1/20 0.30
PAX8 Q06710 1/20 0.30

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
SCHEMBL27748812 0.94 GRM2 (0.35) GRM2
SCHEMBL27637563 0.90 GRM2 (0.37) GRM2
SCHEMBL27754562 0.89 MGLL (0.39) PTGS1PTGS2MGLLFAAHGRM2
SCHEMBL27663496 0.89 MGLL (0.39) PTGS1PTGS2MGLLFAAHGRM2
SCHEMBL27663503 0.89 MGLL (0.39) PTGS1PTGS2MGLLFAAHGRM2
SCHEMBL26606120 0.89 MGLL (0.39) PTGS1PTGS2MGLLFAAHGRM2
SCHEMBL27979483 0.89 MGLL (0.39) PTGS1PTGS2MGLLFAAHGRM2
SCHEMBL27660723 0.89 MGLL (0.39) PTGS1PTGS2MGLLFAAHGRM2
SCHEMBL27683092 0.89 MGLL (0.39) PTGS1PTGS2MGLLFAAHGRM2
SCHEMBL27696873 0.89 MGLL (0.39) PTGS1PTGS2MGLLFAAHGRM2

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
CN-101472932-A Method for production of organosilicon compounds by hydrosilylation in ionic liquids WACKER CHEMIE AG (DE) 2009-07-01 CN disclosed