Pantethine

Pantethine

SCHEMBL19544641

CC(C)(CO)[C@H](O)C(=O)NCCC(=O)NCCSSCCNC(=O)CCNC(=O)[C@H](O)C(C)(C)CO

nearest known ligand 0.56

Full drug profile on Sugi Atlas →

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 1/20 0.56
KCNH2 Q12809 1/20 0.56
VNN1 O95497 13/20 0.50
ZDHHC20 Q5W0Z9 1/20 0.38
ALDH1A1 P00352 1/20 0.34
HDAC2 Q92769 1/20 0.32
CHAT P28329 1/20 0.32

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
Pantethine SCHEMBL1650348 1.00 PTGS1 (0.56) PTGS1KCNH2VNN1ZDHHC20ALDH1A1
Pantethine SCHEMBL59597 1.00 PTGS1 (0.56) PTGS1KCNH2VNN1ZDHHC20ALDH1A1
Pantethine SCHEMBL19358994 0.99 PTGS1 (0.55) PTGS1KCNH2VNN1ZDHHC20ALDH1A1
Pantethine SCHEMBL19359043 0.99 PTGS1 (0.55) PTGS1KCNH2VNN1ZDHHC20ALDH1A1
Pantethine SCHEMBL8416070 0.99 PTGS1 (0.55) PTGS1KCNH2VNN1ZDHHC20ALDH1A1
Pantethine SCHEMBL9112817 0.97 PTGS1 (0.54) PTGS1KCNH2VNN1ZDHHC20ALDH1A1
Pantethine SCHEMBL9115760 0.97 PTGS1 (0.54) PTGS1KCNH2VNN1ZDHHC20ALDH1A1
Pantethine SCHEMBL8416043 0.96 PTGS1 (0.52) PTGS1KCNH2VNN1ZDHHC20ALDH1A1
SCHEMBL18314794 0.95 PTGS1 (0.51) PTGS1KCNH2VNN1ZDHHC20ALDH1A1
SCHEMBL22369798 0.95 PTGS1 (0.51) PTGS1KCNH2VNN1ZDHHC20ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230310461-A1 Compositions and Methods for Treatment of Prediabetes CROSS III WILLIAM H (US) 2023-10-05 US disclosed
US-20170312329-A1 Compositions and Methods for Treatment of Prediabetes CROSS III WILLIAM H (US) 2017-11-02 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-20230310461-A1 Compositions and Methods for Treatment of Prediabetes GPX1, GPX4, NFE2L2 PTGS1 820/4885KCNH2 4318/4885VNN1 2783/4885
US-20170312329-A1 Compositions and Methods for Treatment of Prediabetes GPX4, LPO, GPX1 PTGS1 1442/4885KCNH2 3274/4885VNN1 3841/4885

“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.