SCHEMBL9822642

SCHEMBL9822642

O=S(=O)(O)c1ccccc1N(S(=O)(=O)O)S(=O)(=O)O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TTR P02766 2/20 0.42
MYC P01106 1/20 0.40
TSHR P16473 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
HTR6 P50406 1/20 0.37
MPL P40238 2/20 0.35
ALDH1A1 P00352 2/20 0.35
GAA P10253 2/20 0.35
MAPT P10636 2/20 0.35
KDM4E B2RXH2 1/20 0.35
NSD2 O96028 1/20 0.35
POLB P06746 1/20 0.35
APEX1 P27695 1/20 0.35
APOBEC3A P31941 1/20 0.35
RECQL P46063 1/20 0.35
CASP6 P55212 1/20 0.35
APOBEC3G Q9HC16 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
FABP4 P15090 1/20 0.35

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
SCHEMBL29642609 1.00 TTR (0.42) TTRMYCTSHRSMN1; SMN2HTR6
SCHEMBL30359480 0.80 TTR (0.36) TTRMYCTSHRSMN1; SMN2HTR6
SCHEMBL6265807 0.78 HTR6 (0.60) TTRMYCTSHRSMN1; SMN2HTR6
SCHEMBL27503409 0.78 TTR (0.42) TTRMYCTSHRSMN1; SMN2HTR6
SCHEMBL28326313 0.77 HTR6 (0.58) TTRMYCTSHRSMN1; SMN2HTR6
SCHEMBL8754725 0.76 KDM4E (0.39) TSHRSMN1; SMN2HTR6ALDH1A1MAPT
SCHEMBL29664068 0.75 TSHR (0.55) TTRMYCTSHRSMN1; SMN2HTR6
SCHEMBL150335 0.75 TSHR (0.55) TTRMYCTSHRSMN1; SMN2HTR6
SCHEMBL3281847 0.75 TSHR (0.41) TTRMYCTSHRSMN1; SMN2HTR6
SCHEMBL3282864 0.74 ALDH1A1 (0.40) TSHRSMN1; SMN2ALDH1A1MAPTNSD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0291588-B1 SIZING AGENT KABUSHIKI KAISHA CHIYODA KAGAKU KENKYUSHO (JP) 1991-09-04 EP disclosed
EP-0224976-B1 METHOD OF SIZING PAPER KABUSHIKI KAISHA CHIYODA KAGAKU KENKYUSHO (JP) 1989-10-18 EP disclosed
US-4826570-A PARTIAL ESTER OF ALKENYL SUCCINIC ACID, PAPERMAKING KABUSHIKI KAISHA CHIYODA KAGAKU KENKYUSHO (JP) 1989-05-02 US disclosed
EP-0291588-A1 Sizing agent KABUSHIKI KAISHA CHIYODA KAGAKU KENKYUSHO (JP) 1988-11-23 EP disclosed