SCHEMBL3768216

SCHEMBL3768216

Cc1ccc(S(=O)(=O)O)c(OCC2CC3C=CC2C3)c1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 9/20 0.38
ALDH1A1 P00352 4/20 0.38
PKM P14618 4/20 0.38
MAPT P10636 2/20 0.38
MAPK1 P28482 1/20 0.38
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37
HTT P42858 1/20 0.37
POLB P06746 1/20 0.33
ALOX15 P16050 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
MEP1B Q16820 1/20 0.32
MCOLN3 Q8TDD5 1/20 0.32
RAPGEF4 Q8WZA2 1/20 0.31
LMNA P02545 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
SCHEMBL18544206 0.79 KDM4E (0.39) KDM4EALDH1A1PKMMAPTMAPK1
SCHEMBL11541824 0.75 ALDH1A1 (0.48) ALDH1A1PKMMAPTMEN1KMT2A
SCHEMBL25045972 0.72 MEN1 (0.48) MAPTMAPK1MEN1KMT2AHTT
SCHEMBL22263769 0.70 GRM2 (0.40) KDM4EALDH1A1PKMMAPTMAPK1
SCHEMBL17934494 0.70 KDM4E (0.45) KDM4EALDH1A1PKMMAPTMAPK1
SCHEMBL11225897 0.70 KDM4E (0.45) KDM4EALDH1A1PKMMAPTMAPK1
SCHEMBL18609664 0.70 ALDH1A1 (0.51) KDM4EALDH1A1PKMMEN1KMT2A
SCHEMBL22435423 0.69 TSHR (0.43) KDM4EALDH1A1MAPTMAPK1MEN1
SCHEMBL7525322 0.68 L3MBTL1 (0.42) KDM4EALDH1A1MAPTMAPK1MEN1
SCHEMBL6278523 0.68 CA1 (0.44) KDM4EALDH1A1PKMMAPTMAPK1

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
US-7851575-B2 Polycyclic polymers containing pendant ion conducting moieties PROMERUS LLC (US) 2010-12-14 US disclosed
US-20080242750-A1 Polycyclic polymers containing pendant ion conducting moieties PROMERUS LLC 2008-10-02 US disclosed
US-7312292-B2 Polycyclic polymers containing pendant ion conducting moieties PROMERUS LLC (US) 2007-12-25 US disclosed
US-20050019638-A1 Polycyclic polymers containing pendant ion conducting moieties SUMITOMO BAKELITE CO., LTD. (JP) 2005-01-27 US disclosed