SCHEMBL23732172

SCHEMBL23732172

CCOC(=O)c1c(S(=O)(=O)Cl)c(-c2ccccc2)n(C)c1CC

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.51
ALDH1A1 P00352 4/20 0.51
KDM4E B2RXH2 4/20 0.51
HPGD P15428 3/20 0.51
LMNA P02545 3/20 0.51
GAA P10253 2/20 0.51
TSHR P16473 5/20 0.45
L3MBTL1 Q9Y468 2/20 0.44
HTT P42858 1/20 0.44
HSD17B10 Q99714 1/20 0.44
MAPT P10636 4/20 0.43
NPSR1 Q6W5P4 2/20 0.43
KMT2A Q03164 2/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
KDM4C Q9H3R0 1/20 0.43
GRM6 O15303 1/20 0.43
CYP19A1 P11511 1/20 0.42
ADORA3 P0DMS8 1/20 0.42
GABRA2 P47869 1/20 0.42

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
SCHEMBL23732167 0.91 SMN1; SMN2 (0.54) SMN1; SMN2ALDH1A1KDM4EHPGDLMNA
SCHEMBL23732217 0.88 ALDH1A1 (0.48) SMN1; SMN2ALDH1A1KDM4EHPGDLMNA
SCHEMBL23732220 0.81 ALDH1A1 (0.51) SMN1; SMN2ALDH1A1KDM4EHPGDLMNA
SCHEMBL23732168 0.79 KMT2A (0.45) KDM4ELMNAKMT2AKDM4CMEN1
SCHEMBL9204471 0.75 CYP19A1 (0.51) SMN1; SMN2ALDH1A1KDM4EHPGDTSHR
SCHEMBL23732173 0.74 KMT2A (0.49) KDM4ELMNAKMT2AKDM4CMEN1
SCHEMBL1127080 0.74 TSHR (0.55) SMN1; SMN2ALDH1A1KDM4EHPGDLMNA
SCHEMBL23732190 0.74 GRIA2 (0.41) SMN1; SMN2ALDH1A1KDM4EHPGDL3MBTL1
SCHEMBL23732218 0.70 KMT2A (0.46) SMN1; SMN2ALDH1A1KDM4EHPGDGAA
SCHEMBL23127817 0.70 KMT2A (0.43) SMN1; SMN2ALDH1A1KDM4EHPGDGAA

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
US-20210236463-A1 beta-LACTAMASE INHIBITOR NATIONAL UNIVERSITY CORPORATION TOKAI NATIONAL HIGHER EDUCATION AND RESEARCH SYSTEM (JP) 2021-08-05 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 (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-20210236463-A1 beta-LACTAMASE INHIBITOR MGAM, CMBL, MGAM2 SMN1; SMN2 3073/4885ALDH1A1 683/4885KDM4E 1714/4885

“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.