SCHEMBL29091682

SCHEMBL29091682

CCCCCCCC[PH](CCCCCCCC)(CCCCCCCC)CCCCCCCC.NS(=O)(=O)C(F)F

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CA2 P00918 15/20 0.52
CA1 P00915 9/20 0.39
CA9 Q16790 8/20 0.39
CA12 O43570 3/20 0.39
CA7 P43166 3/20 0.39
CA14 Q9ULX7 3/20 0.39
CA3 P07451 2/20 0.39
CA4 P22748 2/20 0.39
CA6 P23280 2/20 0.39
CA5A P35218 2/20 0.39
CA5B Q9Y2D0 2/20 0.39
FAAH O00519 2/20 0.39
CES2 O00748 1/20 0.35

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
SCHEMBL29091694 0.92 CA2 (0.46) CA2CA1CA9CA12CA7
Trifluoromethanesulfonamide SCHEMBL2730964 0.80 EPHX1 (0.48) CA2CA1CA9CA12CA7
SCHEMBL5305600 0.75 TSHR (0.57)
SCHEMBL22264528 0.75 TSHR (0.57)
SCHEMBL5306320 0.75 TSHR (0.57)
SCHEMBL23137278 0.75 TSHR (0.57)
SCHEMBL5293789 0.75 TSHR (0.57)
SCHEMBL23758986 0.75 TSHR (0.57)
SCHEMBL22264519 0.75 TSHR (0.57)
SCHEMBL23758978 0.75 TSHR (0.57)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115181530-B Adhesive, adhesive sheet, and laminate 东洋油墨SC控股株式会社 2023-10-20 CN disclosed