SCHEMBL20545504

SCHEMBL20545504

O=C(CCCCCCSc1ccccc1)NO

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 15/20 1.00
HDAC8 Q9BY41 12/20 1.00
HDAC2 Q92769 9/20 1.00
HDAC6 Q9UBN7 8/20 1.00
HDAC5 Q9UQL6 8/20 1.00
HDAC4 P56524 7/20 1.00
HDAC7 Q8WUI4 7/20 1.00
HDAC11 Q96DB2 7/20 1.00
HDAC9 Q9UKV0 7/20 1.00
HDAC3 O15379 7/20 1.00
HDAC10 Q969S8 6/20 1.00
ALDH1A1 P00352 1/20 0.59
CYP3A4 P08684 2/20 0.58
ALOX5 P09917 1/20 0.58
KDM4E B2RXH2 1/20 0.58
BRD4 O60885 1/20 0.58
NCOR1 O75376 1/20 0.58
NR1I2 O75469 1/20 0.58
EGFR P00533 1/20 0.58
LTA4H P09960 1/20 0.58

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
SCHEMBL7317658 1.00 HDAC1 (1.00) HDAC1HDAC8HDAC2HDAC6HDAC5
SCHEMBL20590117 0.98 HDAC1 (0.97) HDAC1HDAC8HDAC2HDAC6HDAC5
SCHEMBL11616196 0.93 HDAC1 (0.87) HDAC1HDAC8HDAC2HDAC6HDAC5
SCHEMBL20545519 0.84 HDAC1 (0.73) HDAC1HDAC8HDAC2HDAC6HDAC5
SCHEMBL3209879 0.84 HDAC1 (1.00) HDAC1HDAC8HDAC2HDAC6HDAC5
SCHEMBL20545011 0.84 HDAC1 (0.73) HDAC1HDAC8HDAC2HDAC6HDAC5
SCHEMBL11308257 0.83 HDAC1 (0.71) HDAC1HDAC8HDAC2HDAC6HDAC5
SCHEMBL17141115 0.83 HDAC1 (0.71) HDAC1HDAC8HDAC2HDAC6HDAC5
SCHEMBL20545498 0.83 HDAC1 (0.71) HDAC1HDAC8HDAC2HDAC6HDAC5
SCHEMBL29371532 0.83 HDAC1 (0.71) HDAC1HDAC8HDAC2HDAC6HDAC5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12478594-B2 Methods of treatment of kidney injury associated with infection or trauma University of Pittsburgh—of the Commonwealth System of Higher Education (US) 2025-11-25 US disclosed
US-20220226266-A1 Methods of Treatment of Kidney Injury Associated with Infection or Trauma NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2022-07-21 US disclosed
WO-2020240524-A2 METHODS OF TREATMENT OF KIDNEY INJURY ASSOCIATED WITH INFECTION OR TRAUMA UNIVERSITY OF PITTSBURGH - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2020-12-03 WO disclosed
US-20200207691-A1 Class of HDAC Inhibitors Expands the Renal Progenitor Cells Population and Improves the Rate of Recovery from Acute Kidney Injury UNIVERSITY OF PITTSBURGH - OF T 2020-07-02 US disclosed
US-20200207691-A1 Class of HDAC Inhibitors Expands the Renal Progenitor Cells Population and Improves the Rate of Recovery from Acute Kidney Injury UNIVERSITY OF PITTSBURGH - OF T 2020-07-02 US disclosed
US-10626071-B2 Class of HDAC inhibitors expands the renal progenitor cells population and improves the rate of recovery from acute kidney injury University of Pittsburgh—of the Commonwealth System of Higher Education (US) 2020-04-21 US disclosed
US-10626071-B2 Class of HDAC inhibitors expands the renal progenitor cells population and improves the rate of recovery from acute kidney injury University of Pittsburgh—of the Commonwealth System of Higher Education (US) 2020-04-21 US disclosed
US-10160705-B2 Class of HDAC inhibitors expands the renal progenitor cells population and improves the rate of recovery from acute kidney injury University of Pittsburgh—of the Commonwealth System of Higher Education (US) 2018-12-25 US disclosed
US-20180312455-A1 Class of HDAC Inhibitors Expands the Renal Progenitor Cells Population and Improves the Rate of Recovery from Acute Kidney Injury UNIVERSITY OF PITTSBURGH - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION 2018-11-01 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 (6 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-10160705-B2 Class of HDAC inhibitors expands the renal progenitor cells population and improves the rate of recovery from acute kidney injury HDAC1, HDAC9, HDAC11 HDAC1 1/4885HDAC8 7/4885HDAC2 6/4885
US-20220226266-A1 Methods of Treatment of Kidney Injury Associated with Infection or Trauma MMP8, PLAU, KLKB1 HDAC1 1068/4885HDAC8 1136/4885HDAC2 1113/4885
US-10626071-B2 Class of HDAC inhibitors expands the renal progenitor cells population and improves the rate of recovery from acute kidney injury HDAC1, HDAC9, HDAC11 HDAC1 1/4885HDAC8 7/4885HDAC2 6/4885
US-20180312455-A1 Class of HDAC Inhibitors Expands the Renal Progenitor Cells Population and Improves the Rate of Recovery from Acute Kidney Injury HDAC1, HDAC9, HDAC11 HDAC1 1/4885HDAC8 7/4885HDAC2 6/4885
US-20200207691-A1 Class of HDAC Inhibitors Expands the Renal Progenitor Cells Population and Improves the Rate of Recovery from Acute Kidney Injury HDAC1, HDAC9, HDAC11 HDAC1 1/4885HDAC8 7/4885HDAC2 6/4885
US-12478594-B2 Methods of treatment of kidney injury associated with infection or trauma HDAC1, HDAC2, HDAC4 HDAC1 1/4885HDAC8 8/4885HDAC2 2/4885

“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.