SCHEMBL2489571

SCHEMBL2489571

O=C(c1ccc(F)c(S(=O)(=O)O)c1)c1ccc(F)c(S(=O)(=O)O)c1.[KH].[KH]

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PTK2B Q14289 2/20 0.44
HSD17B14 Q9BPX1 1/20 0.41
CES2 O00748 1/20 0.41
CES1 P23141 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.39
MAPT P10636 4/20 0.39
TP53 P04637 3/20 0.39
LMNA P02545 2/20 0.37
TSHR P16473 2/20 0.37
HSD17B1 P14061 2/20 0.37
HSD17B2 P37059 2/20 0.37
TET2 Q6N021 1/20 0.37
ACLY P53396 1/20 0.37
TDP1 Q9NUW8 1/20 0.36

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
SCHEMBL2176795 1.00 PTK2B (0.44) PTK2BHSD17B14CES2CES1SMN1; SMN2
SCHEMBL250118 0.98 PTK2B (0.45) PTK2BHSD17B14CES2CES1SMN1; SMN2
SCHEMBL14547178 0.96 PTK2B (0.44) PTK2BHSD17B14CES2CES1SMN1; SMN2
SCHEMBL1682113 0.96 PTK2B (0.44) PTK2BHSD17B14CES2CES1SMN1; SMN2
SCHEMBL1681521 0.96 PTK2B (0.44) PTK2BHSD17B14CES2CES1SMN1; SMN2
SCHEMBL250982 0.91 LTA4H (0.46) PTK2BHSD17B14CES2CES1SMN1; SMN2
SCHEMBL28471630 0.90 PTK2B (0.50) PTK2BHSD17B14SMN1; SMN2MAPTTP53
SCHEMBL14392237 0.88 PTK2B (0.39) PTK2BHSD17B14CES2CES1SMN1; SMN2
SCHEMBL14488203 0.88 HSD17B1 (0.42) PTK2BSMN1; SMN2MAPTTP53LMNA
SCHEMBL25759474 0.88 HSD17B1 (0.42) PTK2BHSD17B14SMN1; SMN2MAPTTP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2009724-B1 METHOD FOR PRODUCING POLYMER ELECTROLYTE MEMBRANE, POLYMER ELECTROLYTE MEMBRANE AND DIRECT METHANOL FUEL CELL SUMITOMO CHEMICAL CO (JP) 2011-10-26 EP disclosed
US-20090274944-A1 METHOD FOR PRODUCING POLYMER ELECTROLYTE MEMBRANE, POLYMER ELECTROLYTE MEMBRANE AND DIRECT METHANOL FUEL CELL SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-11-05 US disclosed
EP-2009724-A1 METHOD FOR PRODUCING POLYMER ELECTROLYTE MEMBRANE, POLYMER ELECTROLYTE MEMBRANE AND DIRECT METHANOL FUEL CELL Sumitomo Chemical Company, Limited (JP) 2008-12-31 EP disclosed