SCHEMBL4624985

SCHEMBL4624985

C=C(CCC)C(=O)ON(C)S(=O)(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F

nearest known ligand 0.31

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CA1 P00915 4/20 0.31
CA2 P00918 4/20 0.31
MMP1 P03956 4/20 0.31
MMP2 P08253 4/20 0.31
MMP9 P14780 4/20 0.31
MMP8 P22894 4/20 0.31
MMP13 P45452 4/20 0.31
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
SCHEMBL27608881 0.89 MMP1 (0.32) CA1CA2MMP1MMP2MMP9
SCHEMBL8459259 0.88 F2 (0.33) CA1CA2MMP1MMP2MMP9
SCHEMBL28386781 0.88 F2 (0.33) CA1CA2MMP1MMP2MMP9
SCHEMBL997988 0.76 CA1 (0.31) CA1CA2MMP1MMP2MMP9
SCHEMBL28380675 0.75 F2 (0.31) CA1CA2MMP1MMP2MMP9
SCHEMBL28411538 0.75 F2 (0.31) CA1CA2MMP1MMP2MMP9
SCHEMBL3374284 0.74 F2 (0.31) CA1CA2MMP1MMP2MMP9
SCHEMBL28673414 0.73 CA2 (0.39) CA1CA2MMP1MMP2MMP9
SCHEMBL6924918 0.73 F2 (0.32) CA1CA2MMP1MMP2MMP9
SCHEMBL3372465 0.72

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1385892-B1 FLUOROALKYL POLYMERS CONTAINING CATIONIC SEGMENTS AND COMPOSITION FOR IMPARTING STAIN RELEASE PROPERTIES TO A SUBSTRATE. 3M INNOVATIVE PROPERTIES CO (US) 2008-07-02 EP disclosed
EP-1516885-A2 Novel fluoroalkyl polymers containing a cationogenic segment 3M Innovative Properties Company (US) 2005-03-23 EP disclosed
EP-1385892-A2 NOVEL FLUOROALKYL POLYMERS CONTAINING CATIONIC SEGMENT 3M Innovative Properties Company (US) 2004-02-04 EP disclosed
US-6482911-B1 Fluoroalkyl polymers containing a cationogenic segment 3M INNOVATIVE PROPERTIES COMPANY 2002-11-19 US disclosed
WO-2002090402-A2 NOVEL FLUOROALKYL POLYMERS CONTAINING CATIONIC SEGMENT 3M INNOVATIVE PROPERTIES COMPANY (US) 2002-11-14 WO disclosed