SCHEMBL17898496

SCHEMBL17898496

CC(=O)CS(=O)(=O)NC(C)(C)C

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.33
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
ALDH1A1 P00352 1/20 0.31
POLB P06746 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL1128629 0.81 POLB (0.42) GAALMNAMAPTALDH1A1POLB
SCHEMBL21393560 0.79 ALDH1A1 (0.38) GAALMNAMAPTALDH1A1
SCHEMBL19103697 0.77 TSHR (0.39) GAAMAPTPOLBSMN1; SMN2
SCHEMBL17036729 0.72 ALDH1A1 (0.32) GAALMNAMAPTALDH1A1
SCHEMBL10154890 0.72
SCHEMBL8095041 0.71 ALDH1A1 (0.33) LMNAMAPTALDH1A1SMN1; SMN2
SCHEMBL14489954 0.69 ALDH1A1 (0.35) LMNAMAPTALDH1A1SMN1; SMN2
SCHEMBL27831938 0.69 ALDH1A1 (0.38) GAALMNAALDH1A1SMN1; SMN2
SCHEMBL10772839 0.68 ALDH1A1 (0.36) LMNAALDH1A1POLBSMN1; SMN2
SCHEMBL19115797 0.68 CA2 (0.30) GAAALDH1A1

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-9977024-B2 Targeted covalent probes and inhibitors of proteins containing redox-sensitive cysteines THE SCRIPPS RESEARCH INSTITUTE (US) 2018-05-22 US disclosed
US-9977024-B2 Targeted covalent probes and inhibitors of proteins containing redox-sensitive cysteines THE SCRIPPS RESEARCH INSTITUTE (US) 2018-05-22 US disclosed
US-20160195532-A1 Targeted Covalent Probes and Inhibitors of Proteins Containing Redox-Sensitive Cysteines THE SCRIPPS RESEARCH INSTITUTE 2016-07-07 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-20160195532-A1 Targeted Covalent Probes and Inhibitors of Proteins Containing Redox-Sensitive Cysteines PTMS, RSU1, QSOX1 GAA 4634/4885LMNA 4645/4885MAPT 4374/4885

“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.