SCHEMBL19792937

SCHEMBL19792937

Cc1cccc(S(=O)(=O)NC(=O)[C@H](CC2CC2)NC(=O)OC(C)(C)C)c1

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
AAK1 Q2M2I8 2/20 0.50
CTSS P25774 2/20 0.49
CTSK P43235 2/20 0.49
BCL2 P10415 3/20 0.47
FBP1 P09467 10/20 0.43
ACACB O00763 1/20 0.43
MCL1 Q07820 1/20 0.41
MAPK1 P28482 1/20 0.41
RORC P51449 1/20 0.41

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
SCHEMBL19801195 0.90 BCL2 (0.56) AAK1CTSSCTSKBCL2ACACB
SCHEMBL18019219 0.89 AAK1 (0.59) AAK1CTSSCTSKBCL2ACACB
SCHEMBL19792935 0.85 BCL2 (0.49) AAK1CTSSCTSKBCL2FBP1
SCHEMBL19792940 0.83 LARS1 (0.57) AAK1CTSSCTSKBCL2ACACB
SCHEMBL18019206 0.80 LARS1 (0.56) AAK1CTSSCTSKBCL2ACACB
SCHEMBL18019221 0.80 LARS1 (0.55) AAK1CTSSCTSKBCL2ACACB
SCHEMBL19792936 0.79 CA2 (0.60) CTSSCTSKFBP1MAPK1
SCHEMBL6502759 0.78 FBP1 (0.55) FBP1
SCHEMBL18019207 0.76 BCL2 (0.48) AAK1CTSSCTSKBCL2MCL1
SCHEMBL19801193 0.74 LARS1 (0.62) AAK1CTSSCTSKBCL2MCL1

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-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 (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-20180022696-A1 NOVEL N-ACYL-ARYLSULFONAMIDE DERIVATIVES AS AMINOACYL-TRNA SYNTHETASE INHIBITORS AARS1, GARS1, ASNS AAK1 2180/4885CTSS 436/4885CTSK 2663/4885

“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.