SCHEMBL16646175

SCHEMBL16646175

[O-][S+](Nc1nccs1)c1ccc(NCc2cccc(Cl)c2Cl)cc1

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALOX12 P18054 7/20 0.52
ALDH1A1 P00352 4/20 0.41
GAA P10253 3/20 0.41
LMNA P02545 1/20 0.41
MAPK1 P28482 1/20 0.41
PKM P14618 1/20 0.38
KMT2A Q03164 3/20 0.37
MEN1 O00255 2/20 0.37
HPGD P15428 2/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
MAPT P10636 1/20 0.36
AURKA O14965 1/20 0.35
CA1 P00915 1/20 0.34
ACHE P22303 1/20 0.34
TP53 P04637 1/20 0.34
TSHR P16473 1/20 0.34

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
SCHEMBL16646117 0.89 ALOX12 (0.66) ALOX12ALDH1A1GAALMNAMAPK1
SCHEMBL16646174 0.81 ALOX12 (0.50) ALOX12ALDH1A1GAALMNAMAPK1
SCHEMBL16646116 0.79 ALOX12 (0.40) ALOX12ALDH1A1GAALMNAMAPK1
SCHEMBL18356879 0.78 ALOX12 (0.81) ALOX12ALDH1A1GAALMNAMAPK1
SCHEMBL26545970 0.78 ALOX12 (0.51) ALOX12ALDH1A1GAALMNAMAPK1
SCHEMBL12534309 0.69 LMNA (0.51) ALDH1A1GAALMNAMAPK1PKM
SCHEMBL18560178 0.69 ALDH1A1 (0.47) ALDH1A1GAAMAPK1PKMKMT2A
SCHEMBL11510283 0.68 MEN1 (0.59) ALOX12ALDH1A1GAAKMT2AMEN1
SCHEMBL18356429 0.68 ALOX12 (1.00) ALOX12ALDH1A1GAALMNAMAPK1
SCHEMBL26545984 0.67 ALOX12 (0.65) ALOX12ALDH1A1GAALMNAMAPK1

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-2015054662-A1 4-((2-HYDROXY-3-METHOXYBENZYL)AMINO) BENZENESULFONAMIDE DERIVATIVES AS 12-LIPOXYGENASE INHIBITORS EASTERN VIRGINIA MEDICAL SCHOOL (US) 2015-04-16 WO disclosed