SCHEMBL7780922

SCHEMBL7780922

Cc1ccc(S(=O)(=O)OCCN(C)C(=O)OCc2ccccc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.50
F13A1 P00488 1/20 0.48
TGM2 P21980 1/20 0.48
TGM1 P22735 1/20 0.48
MAPT P10636 1/20 0.47
P2RX7 Q99572 3/20 0.47
CA1 P00915 4/20 0.45
CA2 P00918 4/20 0.45
ELANE P08246 1/20 0.43
LIMK2 P53671 1/20 0.42
POLB P06746 1/20 0.41
PDE4A P27815 1/20 0.40
PDE4B Q07343 1/20 0.40
PDE4C Q08493 1/20 0.40
PDE4D Q08499 1/20 0.40
ALDH1A1 P00352 2/20 0.39
HTT P42858 1/20 0.39
TAS2R14 Q9NYV8 1/20 0.39
KEAP1 Q14145 1/20 0.39
NFE2L2 Q16236 1/20 0.39

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
SCHEMBL23705526 0.93 LMNA (0.46) LMNAF13A1TGM2TGM1MAPT
SCHEMBL7275310 0.92 LMNA (0.47) LMNAF13A1TGM2TGM1MAPT
SCHEMBL31122411 0.85 LMNA (0.45) LMNAF13A1TGM2TGM1MAPT
SCHEMBL6558512 0.82 F13A1 (0.48) F13A1TGM2TGM1MAPTCA1
SCHEMBL29991156 0.78 CCR5 (0.44) LMNAMAPTP2RX7CA1CA2
SCHEMBL1649505 0.78 F2 (0.40) CA1POLBALDH1A1
SCHEMBL7367495 0.77 ALDH1A1 (0.58) LMNAF13A1TGM2TGM1MAPT
SCHEMBL6924285 0.77 LMNA (0.59) LMNATGM2MAPTP2RX7CA1
SCHEMBL21121252 0.77 LMNA (0.64) LMNAMAPTCA1CA2ELANE
SCHEMBL31420837 0.77 P2RX7 (0.43) LMNAMAPTP2RX7CA1CA2

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-0688314-B1 PRODRUG DERIVATIVES OF ENZYME INHIBITORS WITH HYDROXYL GROUPS, METHODS OF PREPARING THEM AND THEIR USE HOECHST AG (DE) 2001-10-04 EP disclosed
US-5804559-A WATER SOLUBILITY HOECHST AKTIENGESELLSCHAFT (DE) 1998-09-08 US disclosed
EP-0688314-A1 PRODRUG DERIVATIVES OF ENZYME INHIBITORS WITH HYDROXYL GROUPS, METHODS OF PREPARING THEM AND THEIR USE HOECHST AKTIENGESELLSCHAFT (DE) 1995-12-27 EP disclosed
WO-1994021604-A1 PRODRUG DERIVATIVES OF ENZYME INHIBITORS WITH HYDROXYL GROUPS, METHODS OF PREPARING THEM AND THEIR USE HOECHST AKTIENGESELLSCHAFT (DE) 1994-09-29 WO disclosed