SCHEMBL29920403

SCHEMBL29920403

CC[C@H]1COc2cc(F)ccc2[C@@H]1CS(N)(=O)=O

nearest known ligand 0.44

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
LTB4R Q15722 15/20 0.44
LTB4R2 Q9NPC1 11/20 0.44
CA2 P00918 1/20 0.43
NR3C1 P04150 3/20 0.39
NR3C2 P08235 3/20 0.39

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
SCHEMBL29920554 1.00 LTB4R (0.44) LTB4RLTB4R2CA2NR3C1NR3C2
SCHEMBL29920646 0.76 CA2 (0.43) LTB4RLTB4R2CA2NR3C1NR3C2
SCHEMBL29920642 0.76 CA2 (0.43) LTB4RLTB4R2CA2NR3C1NR3C2
SCHEMBL29920290 0.73 CA2 (0.38) LTB4RLTB4R2CA2NR3C1NR3C2
SCHEMBL29920682 0.73 CA2 (0.38) LTB4RLTB4R2CA2NR3C1NR3C2
SCHEMBL29920587 0.70 CA2 (0.32) LTB4RLTB4R2CA2NR3C1NR3C2
SCHEMBL29920659 0.70 CA2 (0.32) LTB4RLTB4R2CA2NR3C1NR3C2
SCHEMBL29920510 0.70 CA2 (0.32) LTB4RLTB4R2CA2NR3C1NR3C2
SCHEMBL12237084 0.67 LTB4R (0.47) LTB4RLTB4R2
SCHEMBL14376996 0.67 LTB4R (0.47) LTB4RLTB4R2

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-2022217248-A1 SUBSTITUTED SULFONAMIDE-CHROMAN COMPOUNDS, AND PHARMACEUTICAL COMPOSITIONS, AND METHODS OF USE THEREOF SUNOVION PHARMACEUTICALS INC. (US) 2022-10-13 WO disclosed