SCHEMBL23967971

SCHEMBL23967971

CCCCCCCCCCCCCCc1ccc(C2CCC(CCCCC)CC2)c(F)c1F

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.39
GAA P10253 1/20 0.39
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
TYR P14679 2/20 0.37
TP53 P04637 1/20 0.37
CYP3A4 P08684 1/20 0.37
ALOX5 P09917 1/20 0.37
ALOX15 P16050 1/20 0.37
TSHR P16473 1/20 0.37
HTT P42858 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
SPHK1 Q9NYA1 3/20 0.36
CNR2 P34972 1/20 0.34
KCNH2 Q12809 1/20 0.34
CEL P19835 1/20 0.34
OPRL1 P41146 3/20 0.33

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
SCHEMBL9405951 1.00 MAPT (0.39) MAPTGAAMEN1KMT2ATYR
SCHEMBL9405974 1.00 MAPT (0.39) MAPTGAAMEN1KMT2ATYR
SCHEMBL9406176 1.00 MAPT (0.39) MAPTGAAMEN1KMT2ATYR
SCHEMBL9405956 1.00 MAPT (0.39) MAPTGAAMEN1KMT2ATYR
SCHEMBL9405967 1.00 MAPT (0.39) MAPTGAAMEN1KMT2ATYR
SCHEMBL23968029 1.00 MAPT (0.39) MAPTGAAMEN1KMT2ATYR
SCHEMBL9406171 1.00 MAPT (0.39) MAPTGAAMEN1KMT2ATYR
SCHEMBL21615699 0.99 MAPT (0.37) MAPTGAAMEN1KMT2ATYR
SCHEMBL9406110 0.99 MAPT (0.37) MAPTGAAMEN1KMT2ATYR
SCHEMBL9406104 0.99 MAPT (0.37) MAPTGAAMEN1KMT2ATYR

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
EP-3481916-B1 ELECTRONIC SWITCH MERCK PATENT GMBH (DE) 2021-11-03 EP disclosed