SCHEMBL9260481

SCHEMBL9260481

CN(C)C(=O)CCCc1ncc(S(N)(=O)=O)s1

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
LOXL2 Q9Y4K0 14/20 0.37
MKNK1 Q9BUB5 2/20 0.36
LOX P28300 1/20 0.35
ALDH1A1 P00352 1/20 0.34
NPC1 O15118 1/20 0.33
LMNA P02545 1/20 0.33
RAB9A P51151 1/20 0.33
TBXAS1 P24557 1/20 0.33

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
SCHEMBL9263746 0.77 LOXL2 (0.36) LOXL2LOX
SCHEMBL7529843 0.77 LOXL2 (0.41) LOXL2LOX
SCHEMBL9095364 0.76 LOXL2 (0.48) LOXL2LOXALDH1A1
SCHEMBL9257485 0.76 CA2 (0.45) LOXL2LOX
SCHEMBL7559698 0.73 LOXL2 (0.42) LOXL2LOX
SCHEMBL9259186 0.72 LOXL2 (0.37) LOXL2LOX
SCHEMBL9095386 0.71 LOXL2 (0.44) LOXL2LOX
SCHEMBL21963284 0.71 LOXL2 (0.51) LOXL2LOX
SCHEMBL24979121 0.70 LOXL2 (0.39) LOXL2LOX
SCHEMBL9828530 0.69 CA2 (0.50) LOXALDH1A1

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-1995029904-A1 SUBSTITUTED THIAZOLE SULFONAMIDES AS ANTIGLAUCOMA AGENTS ALLERGAN (US) 1995-11-09 WO disclosed