SCHEMBL20048754

SCHEMBL20048754

CC(C)C[C@@H](N)C(=O)N[S@@+]([O-])c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LARS1 Q9P2J5 5/20 0.52
ANPEP P15144 2/20 0.42
RNPEP Q9H4A4 1/20 0.42
DNPEP Q9ULA0 1/20 0.42
AAK1 Q2M2I8 1/20 0.41
SLC7A5 Q01650 1/20 0.41
LTA4H P09960 1/20 0.39
SCN9A Q15858 1/20 0.39
ELANE P08246 1/20 0.39

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
SCHEMBL20048655 1.00 LARS1 (0.52) LARS1ANPEPRNPEPDNPEPAAK1
SCHEMBL30306591 1.00 LARS1 (0.52) LARS1ANPEPRNPEPDNPEPAAK1
SCHEMBL20048648 1.00 LARS1 (0.52) LARS1ANPEPRNPEPDNPEPAAK1
SCHEMBL30306590 1.00 LARS1 (0.52) LARS1ANPEPRNPEPDNPEPAAK1
SCHEMBL20048701 1.00 LARS1 (0.52) LARS1ANPEPRNPEPDNPEPAAK1
SCHEMBL20048732 1.00 LARS1 (0.52) LARS1ANPEPRNPEPDNPEPAAK1
SCHEMBL20048753 1.00 LARS1 (0.52) LARS1ANPEPRNPEPDNPEPAAK1
SCHEMBL20048845 1.00 LARS1 (0.52) LARS1ANPEPRNPEPDNPEPAAK1
SCHEMBL21643165 1.00 LARS1 (0.52) LARS1ANPEPRNPEPDNPEPAAK1
Trifluoroacetic Acid SCHEMBL21643180 0.92 LARS1 (0.46) LARS1ANPEPRNPEPDNPEPAAK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11802110-B2 2-amino-N-(arylsulfinyl)-acetamide compounds as inhibitors of bacterial aminoacyl-tRNA synthetase Oxford Drug Design Limited (GB) 2023-10-31 US disclosed
US-11802110-B2 2-amino-N-(arylsulfinyl)-acetamide compounds as inhibitors of bacterial aminoacyl-tRNA synthetase Oxford Drug Design Limited (GB) 2023-10-31 US disclosed
US-20200039929-A1 2-AMINO-N-(ARYLSULFINYL)-ACETAMIDE COMPOUNDS AS INHIBITORS OF BACTERIAL AMINOACYL-TRNA SYNTHETASE INHIBOX LIMITED (GB) 2020-02-06 US disclosed
WO-2018065611-A1 2-AMINO-N-(ARYLSULFINYL)-ACETAMIDE COMPOUNDS AS INHIBITORS OF BACTERIAL AMINOACYL-TRNA SYNTHETASE Oxford Drug Design Limited (GB) 2018-04-12 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 (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-11802110-B2 2-amino-N-(arylsulfinyl)-acetamide compounds as inhibitors of bacterial aminoacyl-tRNA synthetase AARS1, NSUN3, GARS1 LARS1 21/4885ANPEP 177/4885RNPEP 126/4885
US-20200039929-A1 2-AMINO-N-(ARYLSULFINYL)-ACETAMIDE COMPOUNDS AS INHIBITORS OF BACTERIAL AMINOACYL-TRNA SYNTHETASE AARS1, NSUN3, GARS1 LARS1 21/4885ANPEP 177/4885RNPEP 126/4885

“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.