SCHEMBL4914693

SCHEMBL4914693

CC(=O)c1cc(NC(=O)CCCCCCCCC(=O)Nc2cc(C(C)=O)cc(C(C)=O)c2)cc(C(C)=O)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FURIN P09958 4/20 0.55
HDAC3 O15379 4/20 0.53
HDAC1 Q13547 4/20 0.53
HDAC2 Q92769 4/20 0.53
HDAC10 Q969S8 4/20 0.53
HDAC11 Q96DB2 4/20 0.53
HDAC8 Q9BY41 4/20 0.53
HDAC6 Q9UBN7 4/20 0.53
HDAC4 P56524 2/20 0.53
HDAC7 Q8WUI4 2/20 0.53
HDAC9 Q9UKV0 2/20 0.53
HDAC5 Q9UQL6 2/20 0.53
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
F10 P00742 1/20 0.50
ALDH1A1 P00352 3/20 0.49
LMNA P02545 1/20 0.49
HTT P42858 1/20 0.49
PARP1 P09874 1/20 0.48
PARP10 Q53GL7 1/20 0.48

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
SCHEMBL5974904 1.00 FURIN (0.55) FURINHDAC3HDAC1HDAC2HDAC10
SCHEMBL5974680 1.00 FURIN (0.55) FURINHDAC3HDAC1HDAC2HDAC10
SCHEMBL5974478 1.00 FURIN (0.55) FURINHDAC3HDAC1HDAC2HDAC10
SCHEMBL5973841 1.00 FURIN (0.55) FURINHDAC3HDAC1HDAC2HDAC10
SCHEMBL5974764 0.98 HDAC3 (0.54) FURINHDAC3HDAC1HDAC2HDAC10
SCHEMBL5973806 0.94 FURIN (0.54) FURINHDAC3HDAC1HDAC2HDAC10
SCHEMBL8445590 0.93 FURIN (0.56) FURINHDAC3HDAC1HDAC2HDAC10
SCHEMBL8446705 0.93 FURIN (0.56) FURINHDAC3HDAC1HDAC2HDAC10
SCHEMBL6149232 0.93 FURIN (0.56) FURINHDAC3HDAC1HDAC2HDAC10
SCHEMBL5442050 0.93 FURIN (0.56) FURINHDAC3HDAC1HDAC2HDAC10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8865641-B2 Methods of treatment of fatty liver disease by pharmacological activation of cholinergic pathways THE FEINSTEIN INSTITUTE FOR MEDICAL RESEARCH (US) 2014-10-21 US claimed
US-20120322719-A1 METHODS OF TREATMENT OF FATTY LIVER DISEASE BY PHARMACOLOGICAL ACTIVATION OF CHOLINERGIC PATHWAYS THE FEINSTEIN INSTITUTE FOR MEDICAL RESEARCH (US) 2012-12-20 US claimed
EP-1773304-A2 METHOD OF TREATING ILEUS BY PHARMACOLOGICAL ACTIVATION OF CHOLINERGIC RECEPTORS The Feinstein Institute for Medical Research (US) 2007-04-18 EP claimed
EP-1734941-A2 NEURAL TOURNIQUET The Feinstein Institute for Medical Research (US) 2006-12-27 EP claimed
WO-2006002375-A2 METHOD OF TREATING ILEUS BY PHARMACOLOGICAL ACTIVATION OF CHOLINERGIC RECEPTORS THE FEINSTEIN INSTITUTE FOR MEDICAL RESEARCH (US) 2006-01-05 WO claimed
US-20050282906-A1 Neural tourniquet NORTH SHORE-LONG ISLAND JEWISH RESEARCH INSTITUTE (US) 2005-12-22 US claimed
WO-2005092308-A2 NEURAL TOURNIQUET THE FEINSTEIN INSTITUTE FOR MEDICAL RESEARCH (US) 2005-10-06 WO claimed
EP-0746312-B1 GUANYLHYDRAZONES FOR TREATING INFLAMMATORY CONDITIONS PICOWER INST MED RES (US) 2002-09-25 EP claimed
EP-2543661-B1 Guanylhydrazone compounds, compositions, methods of making and using FERRING BV (NL) 2016-12-07 EP disclosed
US-8865641-B2 Methods of treatment of fatty liver disease by pharmacological activation of cholinergic pathways THE FEINSTEIN INSTITUTE FOR MEDICAL RESEARCH (US) 2014-10-21 US disclosed
EP-1778265-B1 GUANYLHYDRAZONE COMPOUNDS, COMPOSITIONS, METHODS OF MAKING AND USING FERRING BV (NL) 2013-04-24 EP disclosed
US-20120322719-A1 METHODS OF TREATMENT OF FATTY LIVER DISEASE BY PHARMACOLOGICAL ACTIVATION OF CHOLINERGIC PATHWAYS THE FEINSTEIN INSTITUTE FOR MEDICAL RESEARCH (US) 2012-12-20 US disclosed
US-8247455-B2 Guanylhydrazone compounds, compositions, methods of making and using FERRING B.V. (NL) 2012-08-21 US disclosed
US-20110144189-A1 GUANYLHYDRAZONE COMPOUNDS, COMPOSITIONS, METHODS OF MAKING AND USING CYTOKINE PHARMASCIENCES, INC. (US) 2011-06-16 US disclosed
US-5859062-A ADMINISTERING TO TREAT INFLAMMATORY DISEASES MEDIATED BY TUMOR NECROSIS FACTOR THE PICOWER INSTITUTE FOR MEDICAL RESEARCH (US) 1999-01-12 US disclosed
US-5854289-A Guanylhydrazones and their use to treat inflammatory conditions THE PICOWER INSTITUTE FOR MEDICAL RESEARCH (US) 1998-12-29 US disclosed
US-5849794-A Guanylhydrazones and their use to treat inflammatory conditions THE PICOWER INSTITUTE FOR MEDICAL RESEARCH (US) 1998-12-15 US disclosed
US-5753684-A Guanylhydrazones and their use to treat inflammatory conditions THE PICOWER INSTITUTE FOR MEDICAL RESEARCH (US) 1998-05-19 US disclosed
US-5750573-A PREVENTING AND TREATING CACHEXIA, THE CLINICAL SYNDROME OF POOR NUTRITION AND BODILY WASTING ASSOCIATED WITH CANCER AND CHRONIC DISEASES; ARGINASE INHIBITORS THE PICOWER INSTITUTE FOR MEDICAL RESEARCH (US) 1998-05-12 US disclosed
US-5599984-A AROMATIC AMIDINOHYDRAZONES AS INHIBITORS FOR THE UPTAKE OF ARGININE BY MACROPHAGES AND/OR ITS CONVERSION TO UREA; PREVENTION OF NITRIC OXIDE GENERATION; CACHEXIA; METABOLIC SYNDROMES THE PICOWER INSTITUTE FOR MEDICAL RESEARCH (US) 1997-02-04 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 (3 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-20050282906-A1 Neural tourniquet ACHE, CHAT, TFPI FURIN 792/4885HDAC3 64/4885HDAC1 167/4885
US-20110144189-A1 GUANYLHYDRAZONE COMPOUNDS, COMPOSITIONS, METHODS OF MAKING AND USING GMPS, GANC, GLO1 FURIN 1097/4885HDAC3 1065/4885HDAC1 2108/4885
US-20120322719-A1 METHODS OF TREATMENT OF FATTY LIVER DISEASE BY PHARMACOLOGICAL ACTIVATION OF CHOLINERGIC PATHWAYS CHAT, CHKB, CHRM2 FURIN 4686/4885HDAC3 544/4885HDAC1 1287/4885

“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.