SCHEMBL22918336

SCHEMBL22918336

CS(=O)(=O)c1cccc(CS(=O)(=O)C(F)(F)/C(F)=C/CN)c1

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LOXL2 Q9Y4K0 6/20 0.38
GRM2 Q14416 2/20 0.37
GRM3 Q14832 2/20 0.37
ALDH1A1 P00352 1/20 0.36
GAA P10253 1/20 0.36
HSD17B10 Q99714 1/20 0.36
PTK2 Q05397 4/20 0.36
KIF11 P52732 1/20 0.35
KCNQ3 O43525 2/20 0.35
KCNQ2 O43526 2/20 0.35
DRD2 P14416 1/20 0.34
ADRA1D P25100 1/20 0.34
LOX P28300 1/20 0.34
NR1H2 P55055 1/20 0.33
NR1H3 Q13133 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
SCHEMBL22918249 0.82 LOXL2 (0.41) LOXL2ALDH1A1GAAHSD17B10KIF11
SCHEMBL29852265 0.82 LOXL2 (0.41) LOXL2ALDH1A1GAAHSD17B10KIF11
SCHEMBL22918320 0.82 PRSS1 (0.41) LOXL2HSD17B10LOX
SCHEMBL22918299 0.76 NR1H2 (0.46) LOXL2NR1H2NR1H3
SCHEMBL29852396 0.76 NR1H2 (0.46) LOXL2NR1H2NR1H3
SCHEMBL29852658 0.72 KMT2A (0.40) LOXL2ALDH1A1KIF11
SCHEMBL22918327 0.72 KMT2A (0.40) LOXL2ALDH1A1KIF11
SCHEMBL22918247 0.71 AOC3 (0.39) LOXL2ALDH1A1
SCHEMBL1294652 0.71 LOXL2 (0.42) LOXL2GRM2GRM3ALDH1A1GAA
SCHEMBL1294657 0.71 LOXL2 (0.42) LOXL2GRM2GRM3ALDH1A1GAA

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220251036-A1 DIFLUOROHALOALLYLAMINE SULFONE DERIVATIVE INHIBITORS OF LYSYL OXIDASES, METHODS OF PREPARATION, AND USES THEREOF PHARMAXIS LTD. (AU) 2022-08-11 US disclosed
WO-2021012014-A1 DIFLUOROHALOALLYLAMINE SULFONE DERIVATIVE INHIBITORS OF LYSYL OXIDASES, METHODS OF PREPARATION, AND USES THEREOF PHARMAXIS LTD. (AU) 2021-01-28 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20220251036-A1 DIFLUOROHALOALLYLAMINE SULFONE DERIVATIVE INHIBITORS OF LYSYL OXIDASES, METHODS OF PREPARATION, AND USES THEREOF DAO, SMOX, PIGO LOXL2 27/4885GRM2 4491/4885GRM3 4283/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.