SCHEMBL4168980

SCHEMBL4168980

N=C(NO)c1cc(O)c(O)c(O)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.42
LMNA P02545 3/20 0.42
TDP1 Q9NUW8 3/20 0.42
SNCA P37840 3/20 0.42
ALDH1A1 P00352 2/20 0.42
MAPT P10636 2/20 0.42
FUT7 Q11130 2/20 0.42
SELL P14151 2/20 0.42
SELP P16109 2/20 0.42
CA12 O43570 1/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
TP53 P04637 1/20 0.42
CA3 P07451 1/20 0.42
HPGD P15428 1/20 0.42
FUT4 P22083 1/20 0.42
CA4 P22748 1/20 0.42
CA6 P23280 1/20 0.42
DPP4 P27487 1/20 0.42
MAPK1 P28482 1/20 0.42

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
Hydrochloric Acid SCHEMBL4170160 0.98 KDM4E (0.41) KDM4ELMNATDP1SNCAALDH1A1
SCHEMBL13924923 0.82 PTGS2 (0.55) KDM4ELMNATDP1FUT7CA12
SCHEMBL12348318 0.81 HDAC8 (0.30) HDAC6
SCHEMBL3237538 0.78 TTR (0.48) LMNATDP1ALDH1A1MAPTCA1
SCHEMBL261652 0.76 CA1 (0.44) ALDH1A1CA1CA2GAAL3MBTL1
SCHEMBL6377504 0.76 HDAC6 (0.57) KDM4ESNCAMAPTCA12CA1
SCHEMBL8121970 0.76 TTR (0.46) KDM4ELMNAALDH1A1MAPTHPGD
SCHEMBL20580082 0.72 SNCA (0.46) KDM4ELMNASNCAHSD17B10HDAC6
SCHEMBL261538 0.72 GABRA1 (0.40) ALDH1A1
SCHEMBL131601 0.70 KDM4E (0.64) KDM4ELMNATDP1SNCAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1053012-B1 PHARMACEUTICAL COMPOSITIONS COMPRISING PEG-ASPARAGINASE FOR THE TREATMENT OF HIV INFECTIONS ENZON PHARMACEUTICALS INC (US) 2003-07-23 EP claimed
WO-2001010454-A9 PHARMACEUTICAL COMPOSITION COMPRISING PEG-ASPARAGINASE FOR THE TREATMENT OF HIV INFECTION AVENTIS PHARM PROD INC (US) 2002-11-07 WO claimed
EP-1143990-A3 PHARMACEUTICAL COMPOSTIONS COMPRISING PEG-ASPARAGINASE FOR THE TREATMENT OF HIV INFECTIONS Aventis Pharmaceuticals Inc. (US) 2002-03-27 EP claimed
EP-1143990-A2 PHARMACEUTICAL COMPOSTIONS COMPRISING PEG-ASPARAGINASE FOR THE TREATMENT OF HIV INFECTIONS Aventis Pharmaceuticals Inc. (US) 2001-10-17 EP claimed
US-6248782-B1 ADMINISTERING ENZYME INHIBITOR ELFORD HOWARD L (US) 2001-06-19 US claimed
WO-2001010454-A2 PHARMACEUTICAL COMPOSITION COMPRISING PEG-ASPARAGINASE FOR THE TREATMENT OF HIV INFECTION AVENTIS PHARMACEUTICALS PRODUCTS INC. (US) 2001-02-15 WO claimed
EP-1053012-A1 PHARMACEUTICAL COMPOSITIONS COMPRISING PEG-ASPARAGINASE FOR THE TREATMENT OF HIV INFECTIONS Aventis Pharmaceuticals Products Inc. (US) 2000-11-22 EP claimed
WO-1999039732-A1 PHARMACEUTICAL COMPOSITIONS COMPRISING PEG-ASPARAGINASE FOR THE TREATMENT OF HIV INFECTIONS AVENTIS PHARMACEUTICALS PRODUCTS INC. (US) 1999-08-12 WO claimed
EP-0610444-A4 METHOD OF TREATING VIRAL DISEASES. ELFORD HOWARD L (US) 1995-05-17 EP claimed
EP-0610444-A1 METHOD OF TREATING VIRAL DISEASES ELFORD, Howard L. (US) 1994-08-17 EP claimed
WO-1993012782-A1 METHOD OF TREATING VIRAL DISEASES ELFORD HOWARD L (US) 1993-07-08 WO claimed
US-20170100352-A1 Methods for treating or preventing neuroinflammation or autoimmune diseases ELFORD HOWARD L (US) 2017-04-13 US disclosed
US-20170100352-A1 Methods for treating or preventing neuroinflammation or autoimmune diseases ELFORD HOWARD L (US) 2017-04-13 US disclosed
US-9526707-B2 Methods for treating or preventing neuroinflammation or autoimmune diseases ELFORD HOWARD L (US) 2016-12-27 US disclosed
US-9526707-B2 Methods for treating or preventing neuroinflammation or autoimmune diseases ELFORD HOWARD L (US) 2016-12-27 US disclosed
WO-1999048526-A1 METHOD OF RENDERING A HUMAN IMMUNODEFICIENCY VIRUS POPULATION REPLICATION INCOMPETENT $i(IN VIVO) LORI FRANCO (US) 1999-09-30 WO disclosed
WO-1999047146-A1 ANTI-HIV COMBINATION COMPRISING HYDROXYUREA, DDI, AND A PROTEASE INHIBITOR LISZIWIEWICZ JULIANNA (US) 1999-09-23 WO disclosed
WO-1999039732-A1 PHARMACEUTICAL COMPOSITIONS COMPRISING PEG-ASPARAGINASE FOR THE TREATMENT OF HIV INFECTIONS AVENTIS PHARMACEUTICALS PRODUCTS INC. (US) 1999-08-12 WO disclosed
EP-0706387-A1 NEW PROCEDURE TO BLOCK THE REPLICATION OF REVERSE TRANSCRIPTASE DEPENDENT VIRUSES BY THE USE OF INHIBITORS OF DEOXYNUCLEOTIDES SYNTHESIS THE GOVERNMENT OF THE UNITED STATES OF AMERICA, as represented by THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 1996-04-17 EP disclosed
WO-1994027590-A1 NEW PROCEDURE TO BLOCK THE REPLICATION OF REVERSE TRANSCRIPTASE DEPENDENT VIRUSES BY THE USE OF INHIBITORS OF DEOXYNUCLEOTIDES SYNTHESIS THE GOVERNMENT OF THE UNITED STATES OF AMERICA, REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 1994-12-08 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 (1 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-20170100352-A1 Methods for treating or preventing neuroinflammation or autoimmune diseases RNASE1, RNASEH1, TXNRD3 KDM4E 3319/4885LMNA 2888/4885TDP1 210/4885

“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.