SCHEMBL760418

SCHEMBL760418

CC(=O)CC(C)(C)OC(=O)Nc1ccc(S(=O)(=O)N(CC(C)C)[C@H]2CCCCN(C(=O)OC(C)(C)C)C2=O)cc1

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
NAMPT P43490 2/20 0.36
ABL1 P00519 1/20 0.34
RIN1 Q13671 1/20 0.34
PTPN2 P17706 1/20 0.34
PTPN1 P18031 1/20 0.34
PTPN6 P29350 1/20 0.34
ALDH1A1 P00352 1/20 0.34
TGM2 P21980 7/20 0.34
F13A1 P00488 5/20 0.34
TGM1 P22735 2/20 0.34
L3MBTL1 Q9Y468 1/20 0.33
LIPE Q05469 1/20 0.33

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
SCHEMBL2778449 0.90 L3MBTL1 (0.43) MEN1KMT2ANAMPTABL1RIN1
SCHEMBL6258706 0.90 L3MBTL1 (0.43) MEN1KMT2ANAMPTABL1RIN1
SCHEMBL10128793 0.84 GPR119 (0.41) ALDH1A1
SCHEMBL7744031 0.83 CCR5 (0.41) ALDH1A1
SCHEMBL760419 0.80 GPR119 (0.36) ALDH1A1TGM2
SCHEMBL8051176 0.67 PSEN1 (0.40) MEN1KMT2AALDH1A1L3MBTL1
SCHEMBL8251763 0.66 PSEN1 (0.60)
SCHEMBL20379360 0.63 ALDH1A1 (0.47) MEN1KMT2ANAMPTALDH1A1
SCHEMBL13405090 0.62 PSEN1 (0.38) MEN1KMT2APTPN1ALDH1A1L3MBTL1
SCHEMBL8054683 0.62 PSEN1 (0.38) MEN1KMT2APTPN1ALDH1A1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2064177-B1 PROTEASE INHIBITORS TAIMED BIOLOGICS INC (TW) 2017-04-05 EP disclosed
EP-2165709-B1 Pharmaceutical compositions comprising a lysine based compound and an HIV antiviral or antiretroviral agent AMBRILIA BIOPHARMA INC (CA) 2016-03-16 EP disclosed
EP-1877091-B1 METHOD FOR IMPROVING PHARMACOKINETICS OF PROTEASE INHIBITORS AND PROTEASE INHIBITOR PRECURSORS TAIMED BIOLOG INC (TW) 2015-03-25 EP disclosed
US-8742158-B2 Protease inhibitors TaiMed Biologies, Inc. (TW) 2014-06-03 US disclosed
US-8580995-B2 Lysine-based prodrugs of aspartyl protease inhibitors and processes for their preparation TAIMED BIOLOGICS, INC. (TW) 2013-11-12 US disclosed
US-20130158261-A1 PROTEASE INHIBITORS TAIMED BIOLOGICS, INC. (TW) 2013-06-20 US disclosed
US-8227450-B2 Lysine-based prodrugs of aspartyl protease inhibitors and processes for their preparation AMBRILIA BIOPHARMA INC. (CA) 2012-07-24 US disclosed
US-20120053139-A1 METHOD FOR IMPROVING PHARMACOKINETICS OF PROTEASE INHIBITORS AND PROTEASE INHIBITOR PRECURSORS AMBRILIA BIOPHARMA INC. (CA) 2012-03-01 US disclosed
US-8008297-B2 (1-{5-[(4-amino-benzenesulfonyl)-isobutyl-amino]-6-phosphonooxy-hexacarbomoyl}-2,2-diphenyl-ethyl)-carbamic acid methyl ester; which upon cleavage of cleavable bond or unit generates HIV-1 aspartyl protease inhibitor; antiviral agent; good solubility, and bioavailability; HIV or HTLV infection AMBRILIA BIOPHARMA INC. (CA) 2011-08-30 US disclosed
US-20100130765-A1 LYSINE-BASED PRODRUGS OF ASPARTYL PROTEASE INHIBITORS AND PROCESSES FOR THEIR PREPARATION AMBRILIA BIOPHARMA INC. (CA) 2010-05-27 US disclosed
EP-2165709-A2 Lysine based compounds Ambrilia Biopharma Inc. (CA) 2010-03-24 EP disclosed
EP-2109461-A2 METHOD FOR IMPROVING PHARMACOKINETICS Ambrilia Biopharma Inc. (CA) 2009-10-21 EP disclosed
US-20090253926-A1 Lysine-based prodrugs of aspartyl protease inhibitors and processes for their preparation AMBRILLA BIOPHARMA INC. (CA) 2009-10-08 US disclosed
EP-1773763-B1 LYSINE BASED COMPOUNDS AMBRILIA BIOPHARMA INC (CA) 2008-12-17 EP disclosed
US-20080269172-A1 Lysine based compounds TAIMED BIOLOGICS, INC. (TW) 2008-10-30 US disclosed
US-7388008-B2 Lysine based compounds AMBRILIA BIOPHARMA INC. (CA) 2008-06-17 US disclosed
WO-2008023273-A2 METHOD FOR IMPROVING PHARMACOKINETICS AMBRILIA BIOPHARMA INC. (US) 2008-02-28 WO disclosed
EP-1877091-A1 METHOD FOR IMPROVING PHARMACOKINETICS OF PROTEASE INHIBITORS AND PROTEASE INHIBITOR PRECURSORS Ambrilia Biopharma Inc. (CA) 2008-01-16 EP disclosed
WO-2006114001-A1 METHOD FOR IMPROVING PHARMACOKINETICS OF PROTEASE INHIBITORS AND PROTEASE INHIBITOR PRECURSORS AMBRILIA BIOPHARMA INC. (CA) 2006-11-02 WO disclosed
US-20060025592-A1 Lysine based compounds TAIMED BIOLOGICS, INC. (TW) 2006-02-02 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 (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-20060025592-A1 Lysine based compounds DOT1L, H1-2, H1-0 MEN1 2117/4885KMT2A 12/4885NAMPT 2013/4885
US-20090253926-A1 Lysine-based prodrugs of aspartyl protease inhibitors and processes for their preparation PREP, SPINT2, DNPEP MEN1 1910/4885KMT2A 205/4885NAMPT 668/4885
US-20120053139-A1 METHOD FOR IMPROVING PHARMACOKINETICS OF PROTEASE INHIBITORS AND PROTEASE INHIBITOR PRECURSORS SPINT2, PREP, F2RL1 MEN1 3286/4885KMT2A 1225/4885NAMPT 1365/4885
US-20080269172-A1 Lysine based compounds DOT1L, H1-2, H1-0 MEN1 2117/4885KMT2A 12/4885NAMPT 2013/4885
US-20100130765-A1 LYSINE-BASED PRODRUGS OF ASPARTYL PROTEASE INHIBITORS AND PROCESSES FOR THEIR PREPARATION PREP, SPINT2, HPN MEN1 1915/4885KMT2A 198/4885NAMPT 697/4885
US-20130158261-A1 PROTEASE INHIBITORS PREP, CTRL, CTRB1 MEN1 4812/4885KMT2A 1619/4885NAMPT 2223/4885

“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.