SCHEMBL7176207

SCHEMBL7176207

CN(C)CC(=O)OC(C)(C)C

nearest known ligand 0.34

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 1/20 0.34
CYP2D6 P10635 1/20 0.34
HDAC6 Q9UBN7 3/20 0.33
HDAC1 Q13547 2/20 0.33
HDAC2 Q92769 2/20 0.33
HDAC3 O15379 1/20 0.33
HDAC8 Q9BY41 1/20 0.33
CA14 Q9ULX7 3/20 0.33
CA12 O43570 2/20 0.32
CA1 P00915 1/20 0.32
CA7 P43166 1/20 0.32
CA2 P00918 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
NR1D1 P20393 3/20 0.31
TDP1 Q9NUW8 1/20 0.31
GSTO1 P78417 1/20 0.31
CASR P41180 1/20 0.31
NR1H3 Q13133 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
SCHEMBL18510032 0.85 DGAT1 (0.34) DGAT1CYP2D6HDAC6HDAC1HDAC2
SCHEMBL20674807 0.82 DGAT1 (0.34) DGAT1CYP2D6HDAC6HDAC1HDAC2
SCHEMBL27420033 0.82 NR1D1 (0.38) DGAT1CYP2D6HDAC6HDAC1HDAC2
SCHEMBL8861725 0.81 CYP2D6 (0.33) DGAT1CYP2D6HDAC6HDAC1HDAC2
SCHEMBL28409176 0.81 CA14 (0.41) DGAT1CYP2D6HDAC6HDAC1HDAC2
SCHEMBL17308796 0.81 CYP2D6 (0.33) DGAT1CYP2D6HDAC6HDAC1HDAC2
SCHEMBL13676332 0.81 CYP2D6 (0.33) DGAT1CYP2D6HDAC6HDAC1HDAC2
SCHEMBL15143768 0.81 HDAC6 (0.34) DGAT1CYP2D6HDAC6HDAC1HDAC2
SCHEMBL24896787 0.81 NR1D1 (0.33) CYP2D6CA14CA12CA1CA7
SCHEMBL20674802 0.81 CA12 (0.39) CYP2D6CA14CA12CA1CA7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025090774-A1 CHEMOTHERAPEUTIC COMPOUNDS AND METHODS OF USE SEAGEN INC. (US) 2025-05-01 WO disclosed
US-20230271917-A1 AMINO ACIDS PARABILIS MEDICINES, INC. 2023-08-31 US disclosed
WO-2023129667-A1 PYRAZINE COMPOUNDS AS INHIBITORS OF FLT3 BIOMEA FUSION, INC. (US) 2023-07-06 WO disclosed
WO-2023001223-A1 COMPOUNDS AND COMPOSITIONS FOR TARGETED THERAPY OF RENAL DISEASES SHANGHAI MICURX PHARMACEUTICAL CO., LTD. (CN) 2023-01-26 WO disclosed
EP-2887969-B1 NANOPARTICULATE COMPOSITIONS FOR DIAGNOSTIC IMAGING GEN ELECTRIC (US) 2018-08-01 EP disclosed
US-9085587-B2 Inhibitors of hepatitis C virus PRESIDIO PHARMACEUTICALS, INC. (US) 2015-07-21 US disclosed
US-20120251497-A1 INHIBITORS OF HEPATITIS C VIRUS PRESIDIO PHARMACEUTICALS, INC. 2012-10-04 US disclosed
US-20120251497-A1 INHIBITORS OF HEPATITIS C VIRUS PRESIDIO PHARMACEUTICALS, INC. 2012-10-04 US disclosed
US-20120238750-A1 AROMATIC COMPOUND OTSUKA PHARMACEUTICAL CO., LTD. 2012-09-20 US disclosed
US-8236826-B2 Diarylether derivatives as antitumor agents OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2012-08-07 US disclosed
US-20020042431-A1 Zwitterionic tachykinin receptor antagonists MERCK & CO., INC. 2002-04-11 US disclosed
WO-2002024629-A1 ZWITTERIONIC TACHYKININ RECEPTOR ANTAGONISTS MERCK & CO., INC. (US) 2002-03-28 WO disclosed
US-6060476-A α- and β-amino acid hydroxyethylamino sulfonamides useful as retroviral protease inhibitors G. D. SEARLE & CO. (US) 2000-05-09 US disclosed
US-6046190-A FOR INHIBITING RETROVIRAL PROTEASES SUCH AS HUMAN IMMUNODEFICIENCY VIRUS G.D. SEARLE & CO. (US) 2000-04-04 US disclosed
US-6022872-A α- and β-amino acid hydroxyethylamino sulfonyl urea derivatives useful as retroviral protease inhibitors G. D. SEARLE & CO. (US) 2000-02-08 US disclosed
US-5968942-A INHIBITORS OF HIV PROTEASE G. D. SEARLE & CO. (US) 1999-10-19 US disclosed
US-5843946-A α-and β-amino acid hydroxyethylamino sulfonamides useful as retroviral protease inhibitors G.D. SEARLE & CO. (US) 1998-12-01 US disclosed
US-5830897-A AIDS THERAPY G. D. SEARLE & CO. (US) 1998-11-03 US disclosed
EP-0715618-A1 HYDROXYETHYLAMINO SULPHONAMIDES USEFUL AS RETROVIRAL PROTEASE INHIBITORS G.D. SEARLE & CO. (US) 1996-06-12 EP disclosed
EP-0666842-A1 HYDROXYETHYLAMINO SULFAMIC ACID DERIVATIVES USEFUL AS RETROVIRAL PROTEASE INHIBITORS G.D. SEARLE & CO. (US) 1995-08-16 EP 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 (4 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-20020042431-A1 Zwitterionic tachykinin receptor antagonists NPY5R, NPY1R, NPY2R DGAT1 3584/4885CYP2D6 3107/4885HDAC6 1882/4885
US-20120238750-A1 AROMATIC COMPOUND CBR1, CBR3, CYP1A1 DGAT1 2293/4885CYP2D6 339/4885HDAC6 2038/4885
US-20230271917-A1 AMINO ACIDS NPPA, QPCTL, PTMS DGAT1 3623/4885CYP2D6 4204/4885HDAC6 4340/4885
US-20120251497-A1 INHIBITORS OF HEPATITIS C VIRUS HAVCR2, LIPC, HCCS DGAT1 368/4885CYP2D6 2933/4885HDAC6 409/4885

“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.