SCHEMBL6356291

SCHEMBL6356291

O=S(=O)(O)CCC(S)C(CS)S(=O)(=O)O

nearest known ligand 0.50

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 1/20 0.41
PDE4A P27815 1/20 0.41
SLC22A6 Q4U2R8 1/20 0.40
LMNA P02545 1/20 0.31
SLC6A6 P31641 1/20 0.31
CYP2C19 P33261 1/20 0.31
BLM P54132 1/20 0.31

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
SCHEMBL28788388 0.73 SLC22A6 (0.58) PTGS1PDE4ASLC22A6LMNASLC6A6
SCHEMBL28788386 0.71 PTGS1 (0.40) PTGS1PDE4ASLC22A6LMNASLC6A6
SCHEMBL27441194 0.71 PTGS1 (0.46) PTGS1PDE4ASLC22A6LMNASLC6A6
SCHEMBL8895834 0.70 SLC22A6 (0.54) PTGS1PDE4ASLC22A6
SCHEMBL306230 0.69
SCHEMBL8346373 0.69 PTGS1 (0.41) PTGS1PDE4ASLC22A6LMNASLC6A6
SCHEMBL7159617 0.68 PTGS1 (0.37) PTGS1PDE4ASLC22A6LMNASLC6A6
SCHEMBL6777902 0.68 ENPEP (0.41) PTGS1PDE4ALMNASLC6A6CYP2C19
SCHEMBL11197312 0.67 PTGS1 (0.46) PTGS1PDE4ASLC22A6LMNASLC6A6
SCHEMBL80136 0.67 PTGS1 (0.46) PTGS1PDE4ASLC22A6LMNASLC6A6

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-20050282726-A1 Fabric treatment CONOPCO, INC., D/B/A UNILEVER 2005-12-22 US disclosed
US-20050282984-A1 Triazines CONOPCO, INC., D/B/A UNILEVER 2005-12-22 US disclosed