SCHEMBL8462913

SCHEMBL8462913

Cc1ccc(S(=O)(=O)O)c(CCC=C(F)F)c1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.33
MYC P01106 1/20 0.33
HSD17B10 Q99714 1/20 0.33
AMY1A P0DUB6 1/20 0.32
ALOX15 P16050 2/20 0.32
MEP1B Q16820 1/20 0.31
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 1/20 0.31
POLB P06746 1/20 0.31
MAPT P10636 1/20 0.31
RECQL P46063 1/20 0.31
CASP6 P55212 1/20 0.31
KMT2A Q03164 1/20 0.31
ELAVL1 Q15717 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
RAPGEF4 Q8WZA2 1/20 0.31
MPL P40238 1/20 0.30
TAAR1 Q96RJ0 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
SCHEMBL30823619 0.82 GAA (0.41) GAAMYCHSD17B10AMY1AMEP1B
SCHEMBL1180196 0.82 GAA (0.41) GAAMYCHSD17B10AMY1AMEP1B
SCHEMBL8020739 0.82 GAA (0.35) GAAMYCHSD17B10AMY1AMEP1B
SCHEMBL28706146 0.80 GPR52 (0.34) MYCMEN1ALDH1A1POLBMAPT
SCHEMBL242277 0.80 TAAR1 (0.38) GAAMYCHSD17B10AMY1AALOX15
SCHEMBL816601 0.79 GAA (0.39) GAAMYCHSD17B10AMY1AMEP1B
SCHEMBL29975298 0.79 GAA (0.39) GAAMYCHSD17B10AMY1AMEP1B
SCHEMBL30723203 0.79 GAA (0.39) GAAMYCHSD17B10AMY1AMEP1B
SCHEMBL5718625 0.79 GAA (0.39) GAAMYCHSD17B10AMY1AMEP1B
SCHEMBL30716894 0.79 AMY1A (0.44) GAAMYCHSD17B10AMY1AMEP1B

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-5912243-A NOVEL COMPOUNDS FOR CONTROLLING NEMATODES, INSECT OR ACARID PESTS ZENECA LIMITED (GB) 1999-06-15 US disclosed