SCHEMBL28009197

SCHEMBL28009197

O=S(=O)(O)C1(S(=O)(=O)O)C=CC(c2cccc(O)c2O)=CC1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MIF P14174 1/20 0.33
MAOA P21397 2/20 0.32
ALDH1A1 P00352 2/20 0.31
LMNA P02545 2/20 0.31
HPGD P15428 2/20 0.31
ALOX15 P16050 2/20 0.31
HSD17B10 Q99714 2/20 0.31
TDP1 Q9NUW8 2/20 0.31
MAPT P10636 1/20 0.31
TSHR P16473 1/20 0.31
MAOB P27338 1/20 0.31
MAPK1 P28482 1/20 0.31
HTT P42858 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
ADAMTS4 O75173 1/20 0.31
EGFR P00533 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
FYN P06241 1/20 0.31
MMP2 P08253 1/20 0.31

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
SCHEMBL27593702 0.77 ALDH1A1 (0.35) MIFALDH1A1LMNAHPGDALOX15
SCHEMBL27761664 0.76 HPGD (0.34) MIFMAOAALDH1A1LMNAHPGD
SCHEMBL28020180 0.75 ALDH1A1 (0.31) MIFALDH1A1LMNAHPGDALOX15
SCHEMBL447640 0.74 TSHR (0.31) TSHRSMN1; SMN2MMP2
SCHEMBL28215760 0.74 CA1 (0.33) ALDH1A1HSD17B10CA1CA2CA6
SCHEMBL27730584 0.74
Hydrochloric Acid SCHEMBL27544049 0.73 TSHR (0.31) TSHRSMN1; SMN2MMP2
SCHEMBL27890218 0.70
SCHEMBL28009712 0.70 MAOA (0.33) MIFMAOAALDH1A1LMNAHPGD
SCHEMBL27843908 0.70 CA12 (0.32) CA1CA2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104726237-A Yellow-spot-removing dry cleaning agent SHANGHAI PENGGANG IND DEV CO LTD 2015-06-24 CN disclosed
CN-104584297-A polymer electrolyte membrane KURARAY CO 2015-04-29 CN disclosed