SCHEMBL27339152

SCHEMBL27339152

CC(C)(C)CNS(=O)(=O)CC(F)(F)F

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CETP P11597 1/20 0.35
NR3C1 P04150 1/20 0.31
PGR P06401 1/20 0.31
CA12 O43570 2/20 0.31
CA1 P00915 2/20 0.31
CA2 P00918 2/20 0.31
CA9 Q16790 2/20 0.31

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
SCHEMBL15226205 0.83 CETP (0.38) CETPCA1CA2
SCHEMBL1661515 0.76 EPHX1 (0.33) CETP
SCHEMBL12285820 0.75 CA1 (0.32) CA1
SCHEMBL13104023 0.72 ALDH1A1 (0.41)
SCHEMBL22928259 0.71 PGR (0.33) PGR
SCHEMBL16946101 0.71 EPHX1 (0.47) CA12CA1CA2CA9
SCHEMBL28574756 0.71 PGR (0.31) PGR
SCHEMBL8213784 0.70 PGR (0.31) PGR
SCHEMBL25594038 0.70 PGR (0.32) PGR
SCHEMBL12285359 0.70 CA1 (0.33) CA12CA1CA2

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
WO-2023245162-A2 COMPOUNDS FOR TREATMENT A CORONAVIRUS INFECTION TRAWSFYNYDD THERAPEUTICS, INC. (US) 2023-12-21 WO disclosed