SCHEMBL4784495

SCHEMBL4784495

CC(C)c1ccccc1S(=O)(=O)NC1Cc2ccc(O)cc2C1

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.44
CA2 P00918 2/20 0.44
ACHE P22303 2/20 0.44
NR1H2 P55055 9/20 0.43
ALDH1A1 P00352 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
DRD2 P14416 1/20 0.39
HTR6 P50406 1/20 0.39
GRIA2 P42262 3/20 0.39
CYP1A2 P05177 1/20 0.38
TBXA2R P21731 1/20 0.38
PSEN1 P49768 1/20 0.38
PSEN2 P49810 1/20 0.38
APH1B Q8WW43 1/20 0.38
NCSTN Q92542 1/20 0.38
APH1A Q96BI3 1/20 0.38
PSENEN Q9NZ42 1/20 0.38

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
SCHEMBL4782205 0.87 CA1 (0.50) CA1CA2ALDH1A1L3MBTL1MEN1
SCHEMBL4797405 0.85 MAPT (0.43) CA1CA2NR1H2MEN1KMT2A
SCHEMBL4782791 0.83 MEN1 (0.41) NR1H2MEN1KMT2ADRD2HTR6
SCHEMBL4784133 0.81 NR1H2 (0.40) NR1H2MEN1KMT2ADRD2HTR6
SCHEMBL4786224 0.81 TBXA2R (0.41) NR1H2MEN1KMT2ADRD2HTR6
SCHEMBL4781653 0.80 KDM4E (0.43) NR1H2L3MBTL1MEN1KMT2A
SCHEMBL4783093 0.80 PSEN1 (0.43) NR1H2DRD2HTR6PSEN1PSEN2
SCHEMBL4781505 0.80 TBXA2R (0.42) NR1H2ALDH1A1MEN1KMT2ADRD2
SCHEMBL4781658 0.80 KDM4E (0.43) NR1H2L3MBTL1MEN1KMT2A
SCHEMBL15614423 0.80 L3MBTL1 (0.51) ALDH1A1L3MBTL1MEN1KMT2ADRD2

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
WO-2008061006-A1 SUBSTITUTED INDAN-2-YL, TETRAHYDRONAPHTHALEN-2-YL, OR DIHYDR0-2H-CHR0MEN-3-YL ARYLSULFONAMIDES AND METHODS OF THEIR USE WYETH (US) 2008-05-22 WO claimed
WO-2008061006-A1 SUBSTITUTED INDAN-2-YL, TETRAHYDRONAPHTHALEN-2-YL, OR DIHYDR0-2H-CHR0MEN-3-YL ARYLSULFONAMIDES AND METHODS OF THEIR USE WYETH (US) 2008-05-22 WO disclosed