SCHEMBL23524596

SCHEMBL23524596

CCC(Oc1cc(Cl)ncc1[N+](=O)[O-])C(=O)O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.38
PPARA Q07869 1/20 0.38
ALDH1A1 P00352 4/20 0.36
MAPT P10636 4/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
FFAR1 O14842 1/20 0.35
PTGDR2 Q9Y5Y4 1/20 0.35
XDH P47989 1/20 0.35
HTT P42858 2/20 0.35
KDM4E B2RXH2 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
GAA P10253 1/20 0.34
HPGD P15428 1/20 0.34
NPC1 O15118 2/20 0.34
NFKB1 P19838 1/20 0.34
RAB9A P51151 1/20 0.34
NFKB2 Q00653 1/20 0.34
RELA Q04206 1/20 0.34
GRM8 O00222 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
SCHEMBL2950345 0.82 SMN1; SMN2 (0.41) SMN1; SMN2PPARAALDH1A1FFAR1PTGDR2
SCHEMBL2950340 0.82 SMN1; SMN2 (0.41) SMN1; SMN2PPARAALDH1A1FFAR1PTGDR2
SCHEMBL15283821 0.78 PDK1 (0.45) SMN1; SMN2MAPTMEN1KMT2AXDH
SCHEMBL15941562 0.75 ALDH1A1 (0.48) SMN1; SMN2PPARAALDH1A1MAPTHTT
SCHEMBL29572900 0.74 GCK (0.37) NPC1
SCHEMBL22804653 0.74 GCK (0.37) NPC1
SCHEMBL22804656 0.74 GCK (0.37) NPC1
SCHEMBL7508888 0.74 ALDH1A1 (0.51) SMN1; SMN2ALDH1A1MEN1KMT2AHTT
SCHEMBL1100650 0.73 PIN1 (0.50) SMN1; SMN2ALDH1A1MAPTKDM4ETDP1
SCHEMBL29811740 0.73 PIN1 (0.50) SMN1; SMN2ALDH1A1MAPTKDM4ETDP1

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-11612599-B2 Glycosidase inhibitors ASCENEURON SA (CH) 2023-03-28 US disclosed
US-20210186958-A1 GLYCOSIDASE INHIBITORS ASCENEURON SA (CH) 2021-06-24 US 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 (2 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-11612599-B2 Glycosidase inhibitors ENGASE, GAA, GLA SMN1; SMN2 1307/4885PPARA 4165/4885ALDH1A1 635/4885
US-20210186958-A1 GLYCOSIDASE INHIBITORS ENGASE, GAA, GLA SMN1; SMN2 1307/4885PPARA 4165/4885ALDH1A1 635/4885

“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.