SCHEMBL8209698

SCHEMBL8209698

C=C(C)C(=O)OC(C)CN(F)S(=O)(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F

nearest known ligand 0.34

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 9/20 0.34
MMP2 P08253 9/20 0.34
MMP9 P14780 9/20 0.34
MMP8 P22894 9/20 0.34
MMP13 P45452 9/20 0.34
CA1 P00915 6/20 0.34
CA2 P00918 6/20 0.34
F2 P00734 1/20 0.30
PRSS1 P07477 1/20 0.30
PRSS2 P07478 1/20 0.30
PRSS3 P35030 1/20 0.30

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
SCHEMBL3459497 0.99 MMP1 (0.34) MMP1MMP2MMP9MMP8MMP13
SCHEMBL9237820 0.85 CA1 (0.31) MMP1MMP2MMP9MMP8MMP13
SCHEMBL4650782 0.82 MMP1 (0.34) MMP1MMP2MMP9MMP8MMP13
SCHEMBL6685815 0.82
SCHEMBL3458871 0.81 MMP1 (0.34) MMP1MMP2MMP9MMP8MMP13
SCHEMBL6681417 0.78 MMP1 (0.34) MMP1MMP2MMP9MMP8MMP13
SCHEMBL5024952 0.78 MMP1 (0.40) MMP1MMP2MMP9MMP8MMP13
SCHEMBL3820632 0.77 THRB (0.36) MMP1MMP2MMP9MMP8MMP13
SCHEMBL2127580 0.76 MMP1 (0.35) MMP1MMP2MMP9MMP8MMP13
SCHEMBL1778769 0.75 THRB (0.36) MMP1MMP2MMP9MMP8MMP13

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-0981567-A1 FLUOROCHEMICAL COMPOSITION COMPRISING A POLYMER DERIVED FROM A FLUOROCHEMICAL URETHANE (METH)ACRYLATE MONOMER FOR IMPARTING STAIN RELEASE PROPERTIES TO A SUBSTRATE MINNESOTA MINING AND MANUFACTURING COMPANY (US) 2000-03-01 EP disclosed
WO-1998051727-A1 FLUOROCHEMICAL COMPOSITION COMPRISING A POLYMER DERIVED FROM A FLUOROCHEMICAL URETHANE (METH)ACRYLATE MONOMER FOR IMPARTING STAIN RELEASE PROPERTIES TO A SUBSTRATE MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1998-11-19 WO disclosed