SCHEMBL2217059

SCHEMBL2217059

COc1ccc(S(=O)(=O)N(CC(C)C)C[C@@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)cc1

nearest known ligand 0.72

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
SPPL2A Q8TCT8 1/20 0.59

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
SCHEMBL2217063 1.00 SPPL2A (0.59) SPPL2A
SCHEMBL8228349 1.00 SPPL2A (0.59) SPPL2A
SCHEMBL14602751 0.94 SPPL2A (0.58) SPPL2A
SCHEMBL12757909 0.94 SPPL2A (0.58) SPPL2A
SCHEMBL14602750 0.94 SPPL2A (0.58) SPPL2A
SCHEMBL12757911 0.94 SPPL2A (0.58) SPPL2A
SCHEMBL13538161 0.92 SPPL2A (0.52) SPPL2A
SCHEMBL13538238 0.91 SPPL2A (0.49) SPPL2A
SCHEMBL13537646 0.91
SCHEMBL8222588 0.91 SPPL2A (0.49) SPPL2A

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
CN-117304129-A Azaalkanone derivative or pharmaceutically acceptable salt thereof, preparation method and application thereof, and pharmaceutical composition 中国医学科学院医药生物技术研究所 2023-12-29 CN disclosed
US-9487541-B2 Fused tricyclic ether carbamates and their use PURDUE RESEARCH FOUNDATION (US) 2016-11-08 US disclosed
US-9309213-B2 C-3 substituted bicyclooctane based HIV protease inhibitors PURDUE RESEARCH FOUNDATION (US) 2016-04-12 US disclosed
US-9085571-B2 Nonpeptide HIV-1 protease inhibitors PURDUE RESEARCH FOUNDATION (US) 2015-07-21 US disclosed
US-20140315946-A1 NONPEPTIDE HIV-1 PROTEASE INHIBITORS PURDUE RESEARCH FOUNDATION 2014-10-23 US disclosed
US-8791135-B2 Nonpeptide HIV-1 protease inhibitors PURDUE RESEARCH FOUNDATION (US) 2014-07-29 US disclosed
US-20140179754-A1 FUSED TRICYCLIC ETHER CARBAMATES AND THEIR USE NATIONAL UNIVERSITY CORPORATION KUMAMOTO UNIVERSITY (JP) 2014-06-26 US disclosed
US-20140148508-A1 C-3 SUBSTITUTED BICYCLOOCTANE BASED HIV PROTEASE INHIBITORS NATIONAL UNIVERSITY CORPORATION KUMAMOTO UNIVERSITY (JP) 2014-05-29 US disclosed
US-8563597-B2 Fused tricyclic ether carbamates and their use PURDUE RESEARCH FOUNDATION (US) 2013-10-22 US disclosed
US-8501961-B2 HIV protease inhibitors and methods for using PURDUE RESEARCH FOUNDATION (US) 2013-08-06 US disclosed
US-20090023664-A1 ALPHA- AND BETA-AMINO ACID HYDROXYETHYLAMINO SULFONAMIDES USEFUL AS RETROVIRAL PROTEASE INHIBITORS G.D. SEARLE LLC (US) 2009-01-22 US disclosed
EP-1937655-A1 HIV-1 PROTEASE INHIBITORS, AND METHODS OF MAKING AND USING THEM University of Massachusetts (US) 2008-07-02 EP disclosed
US-7320983-B2 α- and β-amino acid hydroxyethylamino sulfonamides useful as retroviral protease inhibitors G.D. SEARLE LLC (US) 2008-01-22 US disclosed
US-7320983-B2 α- and β-amino acid hydroxyethylamino sulfonamides useful as retroviral protease inhibitors G.D. SEARLE LLC (US) 2008-01-22 US disclosed
US-20070190523-A1 Method and compositions for identifying anti-hiv therapeutic compounds GILEAD SCIENCES, INC. 2007-08-16 US disclosed
US-20070190523-A1 Method and compositions for identifying anti-hiv therapeutic compounds GILEAD SCIENCES, INC. 2007-08-16 US disclosed
US-20070078173-A1 Alpha- and beta-amino acid hydroxyethylamino sulfonamides useful as retroviral protease inhibitors G.D. SEARLE & CO. (US) 2007-04-05 US disclosed
US-20070078173-A1 Alpha- and beta-amino acid hydroxyethylamino sulfonamides useful as retroviral protease inhibitors G.D. SEARLE & CO. (US) 2007-04-05 US disclosed
US-20070010489-A1 Cellular accumulation of phosphonate analogs of hiv protease inhibitor compounds GILEAD SCIENCES, INC. 2007-01-11 US disclosed
WO-2007002173-A1 HIV-1 PROTEASE INHIBITORS, AND METHODS OF MAKING AND USING THEM UNIVERSITY OF MASSACHUSETTS (US) 2007-01-04 WO 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-20090023664-A1 ALPHA- AND BETA-AMINO ACID HYDROXYETHYLAMINO SULFONAMIDES USEFUL AS RETROVIRAL PROTEASE INHIBITORS DNPEP, ASPH, PREP SPPL2A 181/4885
US-20140315946-A1 NONPEPTIDE HIV-1 PROTEASE INHIBITORS DNPEP, PRSS1, SERPINB1 SPPL2A 354/4885
US-20140148508-A1 C-3 SUBSTITUTED BICYCLOOCTANE BASED HIV PROTEASE INHIBITORS CTRC, C9, CTSC SPPL2A 1011/4885
US-20070078173-A1 Alpha- and beta-amino acid hydroxyethylamino sulfonamides useful as retroviral protease inhibitors DNPEP, ASPH, PREP SPPL2A 181/4885
US-20140179754-A1 FUSED TRICYCLIC ETHER CARBAMATES AND THEIR USE CTSE, DNPEP, CTSS SPPL2A 2177/4885
US-20070010489-A1 Cellular accumulation of phosphonate analogs of hiv protease inhibitor compounds PPA1, PNP, PPME1 SPPL2A 1140/4885

“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.