SCHEMBL1710439

SCHEMBL1710439

CCCc1cccc(S(=O)(=O)CCCCCOC)c1

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KAT6A Q92794 1/20 0.41
MGLL Q99685 2/20 0.39
FDFT1 P37268 1/20 0.38
LPL P06858 2/20 0.38
LIPG Q9Y5X9 2/20 0.38
MAPK1 P28482 1/20 0.38
PNMT P11086 1/20 0.37
CYP2D6 P10635 1/20 0.36
CNR1 P21554 1/20 0.36
CNR2 P34972 1/20 0.36
PPARG P37231 1/20 0.36
PPARA Q07869 1/20 0.36
NR1H2 P55055 1/20 0.36
NR1H3 Q13133 1/20 0.36
KCNH2 Q12809 1/20 0.35
HRH3 Q9Y5N1 1/20 0.35
HTR6 P50406 1/20 0.35

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
SCHEMBL1722752 0.88 HTR6 (0.46) MGLLMAPK1PNMTNR1H2NR1H3
SCHEMBL3839356 0.81 LPL (0.46) LPLLIPGCYP2D6CNR1CNR2
SCHEMBL3837696 0.79 LPL (0.45) LPLLIPGCYP2D6CNR1CNR2
SCHEMBL1710601 0.78 LMNA (0.43) FDFT1
SCHEMBL10180981 0.77 PSIP1 (0.52) KAT6ALPLLIPGCNR1CNR2
SCHEMBL3837739 0.77 LPL (0.42) LPLLIPGMAPK1CYP2D6PPARG
SCHEMBL28202089 0.76 CA2 (0.48) MAPK1HTR6
SCHEMBL10235643 0.75 LPL (0.50) LPLLIPGCYP2D6CNR1CNR2
SCHEMBL10181083 0.75 PSIP1 (0.48) LPLLIPGCNR2PPARGPPARA
SCHEMBL1710742 0.74 HTR6 (0.51) LPLLIPGHTR6

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
EP-2344451-A2 SULFUR-LINKED COMPOUNDS FOR TREATING OPTHALMIC DISEASES AND DISORDERS Acucela, Inc. (US) 2011-07-20 EP disclosed
WO-2010028088-A2 SULFUR-LINKED COMPOUNDS FOR TREATING OPTHALMIC DISEASES AND DISORDERS ACUCELA, INC. (US) 2010-03-11 WO disclosed