SCHEMBL8634329

SCHEMBL8634329

CCCCCC(C(F)(F)F)S(=O)(=O)C(CCCCC)C(F)(F)F

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.41
EPHX1 P07099 1/20 0.38
FAAH O00519 6/20 0.37
MAPT P10636 1/20 0.36
CES1 P23141 5/20 0.35
CES2 O00748 2/20 0.35
OPRM1 P35372 1/20 0.34
FDPS P14324 1/20 0.34
NR1I2 O75469 1/20 0.34

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
SCHEMBL8638153 0.84 CA1 (0.31)
SCHEMBL28887913 0.83 TP53 (0.47) TP53EPHX1FAAHMAPTCES1
SCHEMBL6049897 0.82 EPHX1 (0.34) TP53EPHX1FAAHMAPTCES1
SCHEMBL4759458 0.82 TP53 (0.46) TP53EPHX1FAAHMAPTCES1
SCHEMBL3873600 0.82 TP53 (0.46) TP53EPHX1FAAHMAPTCES1
SCHEMBL575573 0.81 TP53 (0.38) TP53EPHX1FAAHMAPTCES1
SCHEMBL575574 0.79 TP53 (0.47) TP53EPHX1FAAHMAPTCES1
1,4-Butanediol SCHEMBL576085 0.79 TP53 (0.43) TP53EPHX1FAAHMAPTCES1
SCHEMBL30452688 0.79 CA1 (0.37) TP53EPHX1FAAHMAPTCES2
1,3-Propanediol SCHEMBL575643 0.79 TP53 (0.43) TP53EPHX1FAAHMAPTCES1

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-0707094-B1 Process for preparing perfluoroalkanesulfonyl fluorides MINNESOTA MINING & MFG (US) 1998-07-22 EP disclosed
EP-0707094-A1 Process for preparing perfluoroalkanesulfonyl fluorides MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1996-04-17 EP disclosed
US-5486271-A Process for preparing perfluoroalkanesulfonyl fluorides MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1996-01-23 US disclosed