SCHEMBL18969788

SCHEMBL18969788

COc1ccc(Oc2ccc(S(=O)(=O)c3ccc(C)cc3)cc2)cc1S(=O)(=O)Cl

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.56
L3MBTL1 Q9Y468 2/20 0.56
TDP1 Q9NUW8 1/20 0.56
SMN1; SMN2 Q16637 2/20 0.54
NR1I2 O75469 1/20 0.46
TSHR P16473 2/20 0.44
POLB P06746 1/20 0.44
MAPK1 P28482 1/20 0.44
PKM P14618 1/20 0.44
ALDH1A1 P00352 1/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
GAA P10253 1/20 0.43
TP53 P04637 1/20 0.43
AR P10275 1/20 0.43
MAPT P10636 2/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
LMNA P02545 1/20 0.42

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
SCHEMBL18969789 0.87 TSHR (0.54) HTTL3MBTL1TDP1SMN1; SMN2NR1I2
SCHEMBL19008829 0.86 HTT (0.56) HTTL3MBTL1TDP1SMN1; SMN2NR1I2
SCHEMBL15929602 0.84 HTT (0.63) HTTL3MBTL1TDP1SMN1; SMN2NR1I2
SCHEMBL18969787 0.84 ALDH1A1 (0.47) HTTSMN1; SMN2TSHRPOLBMAPK1
SCHEMBL19008839 0.82 SMN1; SMN2 (0.41) HTTL3MBTL1TDP1SMN1; SMN2TSHR
SCHEMBL19008836 0.82 HTT (0.51) HTTL3MBTL1TDP1SMN1; SMN2NR1I2
SCHEMBL29652438 0.81 MEN1 (0.60) L3MBTL1SMN1; SMN2ALDH1A1MAPTMEN1
SCHEMBL17392336 0.81 MEN1 (0.60) L3MBTL1SMN1; SMN2ALDH1A1MAPTMEN1
SCHEMBL17169295 0.81 HTT (0.54) HTTL3MBTL1TDP1SMN1; SMN2NR1I2
SCHEMBL25841036 0.81 HTT (0.54) HTTL3MBTL1TDP1SMN1; SMN2NR1I2

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
US-20170179526-A1 NOVEL POLYMERS CONTAINING GRAFTED BIS(SULFONYL)IMIDE SODIUM OR LITHIUM SALTS, METHODS FOR PRODUCTION THEREOF AND USES OF SAME AS ELECTROLYTES FOR BATTERIES CDP INNOVATION (FR) 2017-06-22 US disclosed
US-20170170516-A1 NOVEL POLYMERS CONTAINING SULFONAMIDE SODIUM OR LITHIUM SALTS, METHODS FOR PRODUCTION THEREOF AND USES OF SAME AS ELECTROLYTES FOR BATTERIES CDP INNOVATION (FR) 2017-06-15 US disclosed