SCHEMBL27620437

SCHEMBL27620437

c1ccc(SOc2ccc(OSc3ccccc3)cc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.43
MAPT P10636 1/20 0.43
HPGD P15428 1/20 0.43
MGLL Q99685 1/20 0.43
HSD17B10 Q99714 1/20 0.43
ALDH1A1 P00352 1/20 0.38
MAPK1 P28482 1/20 0.38
LTA4H P09960 6/20 0.36
TSHR P16473 1/20 0.36
MAOA P21397 2/20 0.33
NR1H2 P55055 1/20 0.33
BAX Q07812 1/20 0.33
CA4 P22748 1/20 0.33
FFAR1 O14842 1/20 0.31
KCNA3 P22001 1/20 0.31
KCNH2 Q12809 1/20 0.30
MAOB P27338 1/20 0.30
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30
TRPA1 O75762 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
SCHEMBL5695838 0.94 LTA4H (0.43) SMN1; SMN2MAPTHPGDMGLLHSD17B10
Hydrogen Sulfide SCHEMBL27890271 0.92 LTA4H (0.41) SMN1; SMN2MAPTHPGDMGLLHSD17B10
SCHEMBL28562271 0.89 TSHR (0.42) MAPTHPGDALDH1A1TSHRMAOA
SCHEMBL22236903 0.89 CA4 (0.54) SMN1; SMN2MAPTALDH1A1LTA4HCA4
SCHEMBL28544453 0.89 MAOA (0.52) SMN1; SMN2MAPTHSD17B10ALDH1A1MAPK1
SCHEMBL7946309 0.89 MAPT (0.35) SMN1; SMN2MAPTHPGDMGLLHSD17B10
SCHEMBL8521078 0.89 NFE2L2 (0.37) SMN1; SMN2MAPTHPGDMGLLHSD17B10
SCHEMBL3163298 0.84 MAPT (0.35) SMN1; SMN2MAPTHPGDMGLLHSD17B10
SCHEMBL11404352 0.80 ALDH1A1 (0.52) SMN1; SMN2MAPTHPGDHSD17B10ALDH1A1
SCHEMBL27550793 0.80 SMN1; SMN2 (0.52) SMN1; SMN2HSD17B10ALDH1A1MAPK1TSHR

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-1757130-A Polymer electrolyte material, polymer electrolyte part, film electrode composite element and polymer electrolyte fuel cells TORAY INDUSTRIES (JP) 2006-04-05 CN disclosed