SCHEMBL6900376

SCHEMBL6900376

CCCCOC(F)(OCC)C(=O)OC

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CES2 O00748 3/20 0.36
ALDH1A1 P00352 1/20 0.35
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
FAAH O00519 8/20 0.33
EPHX1 P07099 1/20 0.33
ATM Q13315 1/20 0.33
CES1 P23141 5/20 0.32
MEN1 O00255 1/20 0.32
CYP1A2 P05177 1/20 0.32
KMT2A Q03164 1/20 0.32
HSD17B10 Q99714 1/20 0.32
MAPK1 P28482 2/20 0.32
TSHR P16473 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL7261876 0.76 CES2 (0.37) CES2ALDH1A1CA1CA2FAAH
SCHEMBL7560000 0.74 CES2 (0.35) CES2ALDH1A1CA1CA2FAAH
SCHEMBL4919828 0.73 CYP4F2 (0.46) ALDH1A1CA1CA2EPHX1ATM
SCHEMBL7560983 0.70 CES2 (0.46) CES2FAAHEPHX1CES1MEN1
SCHEMBL7563633 0.70 CES2 (0.46) CES2FAAHEPHX1CES1MEN1
SCHEMBL9139695 0.70 CES2 (0.42) CES2FAAHCES1MEN1CYP1A2
SCHEMBL7561382 0.70 CES2 (0.46) CES2FAAHEPHX1CES1MEN1
SCHEMBL7560874 0.70 KMT2A (0.35) ALDH1A1KMT2AHSD17B10TSHRSMN1; SMN2
SCHEMBL27603424 0.70 MEN1 (0.44) ALDH1A1MEN1KMT2AHSD17B10SMN1; SMN2
SCHEMBL7563208 0.69 CES2 (0.41) CES2FAAHCES1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0868477-B1 FLUORINATED ONIUM SALTS, CURABLE COMPOSITIONS CONTAINING SAME, AND METHOD OF CURING USING SAME MINNESOTA MINING & MFG (US) 2004-08-11 EP disclosed
EP-0868477-A1 FLUORINATED ONIUM SALTS, CURABLE COMPOSITIONS CONTAINING SAME, AND METHOD OF CURING USING SAME MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1998-10-07 EP disclosed
US-5734085-A RELEASE AGENT FOR FLUOROPOLYMERS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1998-03-31 US disclosed
WO-1997023556-A1 FLUORINATED ONIUM SALTS, CURABLE COMPOSITIONS CONTAINING SAME, AND METHOD OF CURING USING SAME MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1997-07-03 WO disclosed
WO-1997023490-A1 FLUORINATED PHOSPHONIUM SALTS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1997-07-03 WO disclosed
US-5591804-A VINYLIDENE FLUORIDE POLYMER MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1997-01-07 US disclosed