SCHEMBL27733604

SCHEMBL27733604

Cc1c(S(=O)(=O)NCCC(=O)O)cccc1S(=O)(=O)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.52
ALDH1A1 P00352 6/20 0.49
TBXA2R P21731 2/20 0.49
LMNA P02545 2/20 0.45
THRB P10828 2/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
PKLR P30613 1/20 0.45
CA12 O43570 3/20 0.45
CA9 Q16790 3/20 0.45
SFRP1 Q8N474 1/20 0.44
FABP4 P15090 1/20 0.44
KDM4E B2RXH2 1/20 0.44
GAA P10253 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
MAPT P10636 1/20 0.43

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
SCHEMBL27713188 0.90 CA12 (0.43) ATMALDH1A1TBXA2RLMNATHRB
SCHEMBL4618946 0.82 SFRP1 (0.64) ALDH1A1L3MBTL1SFRP1NPSR1
SCHEMBL19897911 0.81 ATM (0.55) ATMALDH1A1TBXA2RLMNATHRB
SCHEMBL4619320 0.79 SFRP1 (0.71) ATMALDH1A1TBXA2RLMNAPKLR
SCHEMBL1200801 0.77 ALDH1A1 (0.75) ATMALDH1A1TBXA2RLMNAKDM4E
SCHEMBL4617937 0.77 ATM (0.69) ATMALDH1A1TBXA2RLMNASFRP1
SCHEMBL4618980 0.76 RAB9A (0.51) ATMALDH1A1LMNASFRP1KDM4E
Hydrazine SCHEMBL11854301 0.75 ALDH1A1 (0.71) ATMALDH1A1TBXA2RLMNAKDM4E
SCHEMBL4637627 0.74 ALDH1A1 (0.55) ALDH1A1L3MBTL1
SCHEMBL2949015 0.74 FABP4 (0.57) ATMALDH1A1TBXA2RLMNATHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101208299-A Diarylsulfone sulfonamides and use therof WYETH CORP (US) 2008-06-25 CN disclosed