SCHEMBL1681301

SCHEMBL1681301

CC(=S)NC(CCCCN)C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ FOLH1 Q04609 2/20 0.58
▸ CA1 P00915 1/20 0.49
▸ CA2 P00918 1/20 0.49
▸ SLC6A5 Q9Y345 1/20 0.49
▸ GSR P00390 1/20 0.46
▸ RNPEP Q9H4A4 1/20 0.44
▸ SIRT6 Q8N6T7 1/20 0.43
▸ SIRT1 Q96EB6 1/20 0.43
▸ CPB2 Q96IY4 10/20 0.43
▸ MMP2 P08253 1/20 0.41
▸ MMP9 P14780 1/20 0.41
▸ GNPAT O15228 1/20 0.41
▸ SMN1; SMN2 Q16637 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
SCHEMBL1681305 1.00 FOLH1 (0.58) FOLH1CA1CA2SLC6A5GSR
SCHEMBL20530 0.85 FOLH1 (0.62) FOLH1CA1CA2SLC6A5GSR
SCHEMBL20529 0.85 FOLH1 (0.62) FOLH1CA1CA2SLC6A5GSR
SCHEMBL919220 0.85 FOLH1 (0.62) FOLH1CA1CA2SLC6A5GSR
Hydrochloric Acid SCHEMBL15669796 0.84 FOLH1 (0.60) FOLH1CA1CA2SLC6A5GSR
SCHEMBL31390430 0.84 FOLH1 (0.60) FOLH1CA1CA2SLC6A5GSR
SCHEMBL1387574 0.84 FOLH1 (0.60) FOLH1CA1CA2SLC6A5GSR
SCHEMBL31621379 0.84 FOLH1 (0.60) FOLH1CA1CA2SLC6A5GSR
SCHEMBL16238796 0.84 FOLH1 (0.60) FOLH1CA1CA2SLC6A5GSR
SCHEMBL31621381 0.84 FOLH1 (0.60) FOLH1CA1CA2SLC6A5GSR

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 35 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080287653-A1 METHOD FOR PRODUCING INHIBITORS AND INHIBITORS FORMED THEREFROM THE UNIVERSITY OF AKRON (US) 2008-11-20 — — US claimed
US-20080286815-A1 SPECTROPHOTOMETRIC ASSAY FOR HUMAN HISTONE DEACETYLASE 8 THE UNIVERSITY OF AKRON (US) 2008-11-20 — — US claimed
EP-3956026-B9 P16INK4A INHIBITOR FOR PREVENTING OR TREATING HUNTINGTON'S DISEASE UNIV SORBONNE (FR) 2023-10-04 — — EP disclosed
EP-3956026-B1 P16INK4A INHIBITOR FOR PREVENTING OR TREATING HUNTINGTON'S DISEASE UNIV SORBONNE (FR) 2023-06-07 — — EP disclosed
US-20220251564-A1 p16INK4a INHIBITOR FOR PREVENTING OR TREATING HUNTINGTON'S DISEASE SORBONNE UNIVERSITE (FR) 2022-08-11 — — US disclosed
CN-114096313-A P16 for use in the prevention or treatment of Huntington's diseaseINK4aInhibitors 索邦大学 2022-02-25 — — CN disclosed
EP-3956026-A1 P16INK4A INHIBITOR FOR PREVENTING OR TREATING HUNTINGTON'S DISEASE SORBONNE UNIVERSITE (FR) 2022-02-23 — — EP disclosed
CN-110143900-B Methods of treatment using SIRT2 modulators 康奈尔大学 2021-08-03 — — CN disclosed
WO-2020212597-A1 p16INK4a INHIBITOR FOR PREVENTING OR TREATING HUNTINGTON'S DISEASE SORBONNE UNIVERSITE (FR) 2020-10-22 — — WO disclosed
EP-2647720-B1 PEPTIDE LIBRARY PRODUCTION METHOD, PEPTIDE LIBRARY, AND SCREENING METHOD UNIV TOKYO (JP) 2019-06-19 — — EP disclosed
CN-105037278-B Sirt5 regulator and its screening technique 康奈尔大学 2019-05-03 — — CN disclosed
EP-2596122-A2 MODULATORS FOR SIRT5 AND ASSAYS FOR SCREENING SAME Cornell University (US) 2013-05-29 — — EP disclosed
WO-2013052727-A1 METHODS OF TREATMENT USING MODULATORS OF SIRT2 CORNELL UNIVERSITY (US) 2013-04-11 — — WO disclosed
US-20130065248-A1 REAGENTS AND METHODS FOR SIRTUIN CAPTURE CORNELL UNIVERSITY (US) 2013-03-14 — — US disclosed
WO-2012006391-A2 MODULATORS FOR SIRT5 AND ASSAYS FOR SCREENING SAME CORNELL UNIVERSITY (US) 2012-01-12 — — WO disclosed
WO-2011146636-A2 REAGENTS AND METHODS FOR SIRTUIN CAPTURE CORNELL UNIVERSITY (US) 2011-11-24 — — WO disclosed
WO-2011050152-A2 SITE-SPECIFIC MODIFICATION OF PROTEINS THE JOHNS HOPKINS UNIVERSITY (US) 2011-04-28 — — WO disclosed
US-20080287653-A1 METHOD FOR PRODUCING INHIBITORS AND INHIBITORS FORMED THEREFROM THE UNIVERSITY OF AKRON (US) 2008-11-20 — — US disclosed
US-20080287653-A1 METHOD FOR PRODUCING INHIBITORS AND INHIBITORS FORMED THEREFROM THE UNIVERSITY OF AKRON (US) 2008-11-20 — — US disclosed
US-20080286815-A1 SPECTROPHOTOMETRIC ASSAY FOR HUMAN HISTONE DEACETYLASE 8 THE UNIVERSITY OF AKRON (US) 2008-11-20 — — 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-20220251564-A1 p16INK4a INHIBITOR FOR PREVENTING OR TREATING HUNTINGTON'S DISEASE HTT, CDKN1A, TP53 FOLH1 3867/4885CA1 4179/4885CA2 4566/4885
US-20130065248-A1 REAGENTS AND METHODS FOR SIRTUIN CAPTURE SIRT3, SIRT1, SIRT2 FOLH1 1097/4885CA1 2867/4885CA2 2770/4885

“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.

Send feedback