SCHEMBL6274464

SCHEMBL6274464

COC(=O)c1cc(S(=O)(=O)c2ccc(CCN)cc2)cc(OC)c1OCc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 2/20 0.46
PDE4A P27815 1/20 0.43
PDE4B Q07343 1/20 0.43
PDE4C Q08493 1/20 0.43
PDE4D Q08499 1/20 0.43
LMNA P02545 1/20 0.43
HPGD P15428 1/20 0.43
FAAH O00519 1/20 0.40
CNR2 P34972 1/20 0.40
MAPT P10636 1/20 0.40
FFAR4 Q5NUL3 1/20 0.39
SCN9A Q15858 1/20 0.39
KMT2A Q03164 1/20 0.39

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
SCHEMBL6270628 0.89 HTR6 (0.47) HTR6PDE4APDE4BPDE4CPDE4D
SCHEMBL6273783 0.88 SMN1; SMN2 (0.52) LMNAKMT2A
SCHEMBL6273306 0.87 HTR6 (0.45) HTR6LMNAHPGDFFAR4KMT2A
SCHEMBL6272642 0.87 SMN1; SMN2 (0.43) PDE4APDE4BPDE4CPDE4DLMNA
SCHEMBL6269080 0.86 HTR6 (0.50) HTR6PDE4APDE4BPDE4CPDE4D
SCHEMBL6271259 0.82 HTR6 (0.43) HTR6PDE4APDE4BPDE4CPDE4D
SCHEMBL6271452 0.77 CA12 (0.50) KMT2A
SCHEMBL9756722 0.77 LMNA (0.52) LMNAHPGDMAPTFFAR4KMT2A
SCHEMBL6272920 0.76 CA12 (0.48) LMNAKMT2A
SCHEMBL6275310 0.75 L3MBTL1 (0.37) PDE4APDE4BPDE4CPDE4DLMNA

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-2005110981-A1 AMINOALCOHOL DERIVATIVES ASTELLAS PHARMA INC. (JP) 2005-11-24 WO disclosed