SCHEMBL10367192

SCHEMBL10367192

O=S(=O)(N(CCOCC1CO1)CCOCC1CO1)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 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.34
CA2 P00918 2/20 0.33
ALDH1A1 P00352 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
MAPK1 P28482 1/20 0.32
CA1 P00915 1/20 0.30
MMP1 P03956 1/20 0.30
MMP2 P08253 1/20 0.30
MMP9 P14780 1/20 0.30
MMP8 P22894 1/20 0.30
MMP13 P45452 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
SCHEMBL10367256 0.78 CA2 (0.40) CA2CA1MMP1MMP2MMP9
SCHEMBL10368279 0.78 CA2 (0.40) CA2CA1MMP1MMP2MMP9
SCHEMBL10367820 0.76 CA2 (0.40) TSHRSMN1; SMN2CA2ALDH1A1TDP1
SCHEMBL5152620 0.76 CA1 (0.34) CA2CA1MMP1MMP2MMP9
SCHEMBL17956606 0.75 F2 (0.37) CA2CA1MMP1MMP2MMP9
SCHEMBL5551714 0.74 CA2 (0.35) TSHRCA2MAPK1CA1MMP1
SCHEMBL1633836 0.74 CA2 (0.34) CA2CA1MMP1MMP2MMP9
SCHEMBL441682 0.74 CA2 (0.35) CA2CA1MMP1MMP2MMP9
SCHEMBL15932430 0.74 MMP1 (0.36) TSHRCA2MAPK1CA1MMP1
SCHEMBL11345149 0.73 CA2 (0.36) CA2CA1MMP1MMP2MMP9

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-0125826-B1 FLUOROALIPHATIC SULFONAMIDES CONTAINING OXIRANE GROUPS AND/OR N-B-HYDROXYALKYLENE GROUPS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1990-11-14 EP claimed
US-4533713-A WATERPROOFING, OIL-REPELLANT CURED POLYEPOXIDES; PROTECTIVE COATINGS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1985-08-06 US claimed
EP-0125826-A2 Fluoroaliphatic sulfonamides containing oxirane groups and/or N-B-hydroxyalkylene groups MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1984-11-21 EP claimed
EP-0125826-B1 FLUOROALIPHATIC SULFONAMIDES CONTAINING OXIRANE GROUPS AND/OR N-B-HYDROXYALKYLENE GROUPS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1990-11-14 EP disclosed
US-4533713-A WATERPROOFING, OIL-REPELLANT CURED POLYEPOXIDES; PROTECTIVE COATINGS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1985-08-06 US disclosed
EP-0125826-A2 Fluoroaliphatic sulfonamides containing oxirane groups and/or N-B-hydroxyalkylene groups MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1984-11-21 EP disclosed