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Sugi Predict / Compounds / SCHEMBL19255077

SCHEMBL19255077

SCHEMBL19255077

Cc1c(-c2cccc(S(=O)(=O)N(C)C)c2)c2cc(O)ccc2n1C/C(F)=C/CNCl

nearest known ligand 0.82

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ LOXL2 Q9Y4K0 20/20 0.82
▸ DAO P14920 2/20 0.69
▸ AOC3 Q16853 2/20 0.69
▸ LOX P28300 2/20 0.65
▸ LOXL3 P58215 2/20 0.65
▸ LOXL1 Q08397 2/20 0.65
▸ LOXL4 Q96JB6 2/20 0.65

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
SCHEMBL19255073 0.94 LOXL2 (0.76) LOXL2DAOAOC3LOXLOXL3
SCHEMBL19255709 0.92 LOXL2 (0.81) LOXL2DAOAOC3LOXLOXL3
SCHEMBL19255084 0.91 LOXL2 (0.84) LOXL2DAOAOC3LOXLOXL3
SCHEMBL19255065 0.90 LOXL2 (0.82) LOXL2DAOAOC3LOXLOXL3
SCHEMBL19254720 0.90 LOXL2 (1.00) LOXL2DAOAOC3LOXLOXL3
SCHEMBL20699516 0.90 LOXL2 (1.00) LOXL2DAOAOC3LOXLOXL3
Hydrochloric Acid SCHEMBL20699658 0.89 LOXL2 (1.00) LOXL2DAOAOC3LOXLOXL3
Hydrochloric Acid SCHEMBL19211689 0.89 LOXL2 (1.00) LOXL2DAOAOC3LOXLOXL3
SCHEMBL19255405 0.89 LOXL2 (0.83) LOXL2DAOAOC3LOXLOXL3
SCHEMBL19255404 0.89 LOXL2 (0.83) LOXL2DAOAOC3LOXLOXL3

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-2017136870-A1 HALOALLYLAMINE INDOLE AND AZAINDOLE DERIVATIVE INHIBITORS OF LYSYL OXIDASES AND USES THEREOF PHARMAXIS LTD. (AU) 2017-08-17 — — WO disclosed