SCHEMBL19792928

SCHEMBL19792928

CC[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)NS(=O)(=O)c1ccc2ccccc2c1

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CA2 P00918 3/20 0.53
ACACB O00763 1/20 0.52
LARS1 Q9P2J5 1/20 0.52
KDM4E B2RXH2 3/20 0.47
CTSS P25774 2/20 0.47
CTSK P43235 2/20 0.47
ALDH1A1 P00352 2/20 0.47
HPGD P15428 2/20 0.47
KAT6A Q92794 1/20 0.46
BCL2 P10415 2/20 0.44
CTSB P07858 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
GABRB1 P18505 1/20 0.43
GABRB2 P47870 1/20 0.43
RAPGEF3 O95398 1/20 0.43
HTT P42858 1/20 0.42
ADAM17 P78536 1/20 0.42
NLRP3 Q96P20 1/20 0.42
MCL1 Q07820 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
SCHEMBL19792936 0.86 CA2 (0.60) CA2KDM4ECTSSCTSKHPGD
SCHEMBL18019210 0.84 CA2 (0.57) CA2KDM4ECTSSCTSKALDH1A1
SCHEMBL18019205 0.82 LARS1 (0.61) ACACBLARS1CTSSCTSKKAT6A
SCHEMBL23568810 0.82 CA2 (0.52) CA2ACACBLARS1KDM4ECTSS
SCHEMBL18019198 0.81 CA2 (0.48) CA2ACACBLARS1KDM4ECTSS
SCHEMBL9895812 0.80 ACACB (0.61) ACACBLARS1ALDH1A1KAT6ARAPGEF3
SCHEMBL18019217 0.78 LARS1 (0.61) CA2LARS1KDM4ECTSSCTSK
SCHEMBL18019187 0.77 LARS1 (0.68) LARS1ALDH1A1KAT6ARAPGEF3NLRP3
SCHEMBL8284970 0.76 BCL2 (0.53) CA2LARS1KDM4ECTSSCTSK
SCHEMBL14074806 0.76 BCL2 (0.53) CA2LARS1KDM4ECTSSCTSK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11072581-B2 N-acyl-arylsulfonamide derivatives as aminoacyl-tRNA synthetase inhibitors Oxford Drug Design Limited (GB) 2021-07-27 US disclosed
US-20180022696-A1 NOVEL N-ACYL-ARYLSULFONAMIDE DERIVATIVES AS AMINOACYL-TRNA SYNTHETASE INHIBITORS THE LATVIAN INSTITUTE OF ORGANIC SYNTHESIS (LV) 2018-01-25 US disclosed
US-20180022696-A1 NOVEL N-ACYL-ARYLSULFONAMIDE DERIVATIVES AS AMINOACYL-TRNA SYNTHETASE INHIBITORS THE LATVIAN INSTITUTE OF ORGANIC SYNTHESIS (LV) 2018-01-25 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-20180022696-A1 NOVEL N-ACYL-ARYLSULFONAMIDE DERIVATIVES AS AMINOACYL-TRNA SYNTHETASE INHIBITORS AARS1, GARS1, ASNS CA2 4520/4885ACACB 782/4885LARS1 72/4885
US-11072581-B2 N-acyl-arylsulfonamide derivatives as aminoacyl-tRNA synthetase inhibitors AARS1, ASNS, GARS1 CA2 4478/4885ACACB 790/4885LARS1 77/4885

“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.