SCHEMBL6270628

SCHEMBL6270628

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

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 2/20 0.47
HPGD P15428 2/20 0.44
LMNA P02545 1/20 0.44
NAMPT P43490 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
PDE4A P27815 1/20 0.38
PDE4B Q07343 1/20 0.38
PDE4C Q08493 1/20 0.38
PDE4D Q08499 1/20 0.38
FFAR4 Q5NUL3 2/20 0.38
ALDH1A1 P00352 4/20 0.38
KDM4E B2RXH2 2/20 0.38
TSHR P16473 2/20 0.38
SFRP1 Q8N474 1/20 0.38
USP2 O75604 1/20 0.38
HSD17B10 Q99714 1/20 0.38
NPSR1 Q6W5P4 1/20 0.37
POLB P06746 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
GAA P10253 1/20 0.37

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
SCHEMBL6274464 0.89 HTR6 (0.46) HTR6HPGDLMNAPDE4APDE4B
SCHEMBL6273306 0.88 HTR6 (0.45) HTR6HPGDLMNAFFAR4ALDH1A1
SCHEMBL6271452 0.87 CA12 (0.50) ALDH1A1NPSR1GAA
SCHEMBL6271259 0.85 HTR6 (0.43) HTR6HPGDLMNAPDE4APDE4B
SCHEMBL6269080 0.85 HTR6 (0.50) HTR6HPGDLMNAPDE4APDE4B
SCHEMBL6273783 0.77 SMN1; SMN2 (0.52) LMNAALDH1A1KDM4ENPSR1GAA
SCHEMBL6272488 0.77 F2 (0.37) FFAR4
SCHEMBL6272642 0.76 SMN1; SMN2 (0.43) HPGDLMNAPDE4APDE4BPDE4C
SCHEMBL6272920 0.76 CA12 (0.48) LMNAALDH1A1NPSR1GAA
SCHEMBL6271776 0.76 FFAR4 (0.35) L3MBTL1FFAR4

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