SCHEMBL5057159

SCHEMBL5057159

NC(=O)c1csc(NC(=O)[CH]CCCCNC(=O)NOCc2ccccc2)n1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.39
HDAC6 Q9UBN7 5/20 0.38
HDAC3 O15379 4/20 0.37
HDAC4 P56524 4/20 0.37
HDAC1 Q13547 4/20 0.37
HDAC7 Q8WUI4 4/20 0.37
HDAC2 Q92769 4/20 0.37
HDAC10 Q969S8 4/20 0.37
HDAC11 Q96DB2 4/20 0.37
HDAC8 Q9BY41 4/20 0.37
HDAC9 Q9UKV0 4/20 0.37
HDAC5 Q9UQL6 4/20 0.37
ROCK2 O75116 2/20 0.37
ROCK1 Q13464 2/20 0.37
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
TGM2 P21980 1/20 0.34
LMNA P02545 1/20 0.34
GAA P10253 1/20 0.34

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
SCHEMBL7868121 0.88 MAPK1 (0.50) MAPK1HDAC6HDAC3HDAC4HDAC1
SCHEMBL7868065 0.85 MAPK1 (0.48) MAPK1HDAC6HDAC3HDAC4HDAC1
SCHEMBL7874778 0.79 HDAC3 (0.48) HDAC6HDAC3HDAC4HDAC1HDAC7
SCHEMBL7879205 0.72 EPHX2 (0.38) HDAC6HDAC3HDAC4HDAC1HDAC7
SCHEMBL6056911 0.71 PDE5A (0.46) HDAC6HDAC3HDAC4HDAC1HDAC7
SCHEMBL6316630 0.71 ROCK2 (0.62) ROCK2ROCK1
SCHEMBL9781764 0.71 TGM2 (0.51) HDAC6HDAC3HDAC4HDAC1HDAC7
SCHEMBL7873367 0.70 TGM2 (0.49) MAPK1SMN1; SMN2TGM2LMNA
SCHEMBL8241346 0.69 NPC1 (0.51) HDAC3NPC1RAB9ATGM2
SCHEMBL9705390 0.69 HTT (0.64) MAPK1HDAC6HDAC3HDAC4HDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1929014-B1 METHODS OF ALTERING AN IMMUNE RESPONSE INDUCED BY D-TYPE CPG OLIGODEOXYNUCLEOTIDES US GOV HEALTH & HUMAN SERV (US) 2014-08-13 EP disclosed
US-8470342-B2 Methods of altering an immune response induced by CpG oligodeoxynucleotides THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2013-06-25 US disclosed
US-20080249056-A1 Methods of Altering an Immune Response Induced by Cpg Oligodeoxynucleotides THE GOVERNMENT OF THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE DEPARTMENT OF HEALTH AND HUMAN SERVICES 2008-10-09 US disclosed
EP-1929014-A1 METHODS OF ALTERING AN IMMUNE RESPONSE INDUCED BY CPG OLIGODEOXYNUCLEOTIDES The Government of the United States of America as represented by the Secretary of the Department of Health and Human Services (US) 2008-06-11 EP disclosed
WO-2007027718-A1 METHODS OF ALTERING AN IMMUNE RESPONSE INDUCED BY CPG OLIGODEOXYNUCLEOTIDES THE GOVERNMENT OF THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2007-03-08 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-20080249056-A1 Methods of Altering an Immune Response Induced by Cpg Oligodeoxynucleotides CXCL10, CCL2, CXCR6 MAPK1 3329/4885HDAC6 1845/4885HDAC3 3413/4885

“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.