SCHEMBL327593

SCHEMBL327593

O=C(CCSSc1ccccn1)NCCCCC(C(=O)O)N1C(=O)CCC1=O

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.44
FOLH1 Q04609 2/20 0.42
HDAC1 Q13547 13/20 0.41
HDAC2 Q92769 13/20 0.41
HDAC3 O15379 1/20 0.41
HDAC4 P56524 1/20 0.41
HDAC7 Q8WUI4 1/20 0.41
HDAC10 Q969S8 1/20 0.41
HDAC11 Q96DB2 1/20 0.41
HDAC8 Q9BY41 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41
HDAC9 Q9UKV0 1/20 0.41
HDAC5 Q9UQL6 1/20 0.41
ALDH1A1 P00352 2/20 0.38
PKM P14618 1/20 0.38
ALB P02768 1/20 0.36

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
SCHEMBL28851780 0.91 HPGD (0.55) HPGDFOLH1HDAC1HDAC2HDAC3
SCHEMBL1870930 0.89 HPGD (0.39) HPGDFOLH1HDAC1HDAC2HDAC3
SCHEMBL10340280 0.87 HDAC1 (0.47) HDAC1HDAC2HDAC4HDAC6ALDH1A1
SCHEMBL3490799 0.86 ALDH1A1 (0.46) HDAC1HDAC2HDAC4HDAC6ALDH1A1
SCHEMBL1752117 0.84 ALDH1A1 (0.48) HPGDHDAC1HDAC2ALDH1A1PKM
Hydrogen Sulfide SCHEMBL20305480 0.83 ALDH1A1 (0.47) HPGDHDAC1HDAC2ALDH1A1PKM
SCHEMBL29380577 0.82 HPGD (0.57) HPGDHDAC1HDAC2HDAC3HDAC4
SCHEMBL155342 0.82 HPGD (0.57) HPGDHDAC1HDAC2HDAC3HDAC4
SCHEMBL19444563 0.81 HPGD (0.56) HPGDHDAC1HDAC2HDAC3HDAC4
SCHEMBL24274154 0.79 HPGD (0.43) HPGDHDAC1HDAC2HDAC3HDAC4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3765188-B1 SURFACE FUNCTIONALISED MATERIALS FOR SAMPLING BIOLOGICAL MOLECULES JONES PAUL ANTONIO (GB) 2025-04-16 EP claimed
EP-1853634-B1 ACTIVATED SIALIC ACID DERIVATIVES FOR PROTEIN DERIVATISATION AND CONJUGATION LIPOXEN TECHNOLOGIES LTD (GB) 2016-08-10 EP claimed
EP-1776389-B1 SIALIC ACID DERIVATIVES LIPOXEN TECHNOLOGIES LTD (GB) 2016-06-29 EP claimed
EP-2478049-B1 A POLYMER SUPPORT UNIV CAPE TOWN (ZA) 2015-02-25 EP claimed
US-20120135891-A1 METHODS AND DEVICES FOR EARLY DETECTION OF CANCER CELLS AND TYPES THROUGH MICROMECHANICAL INTERACTIONS STIHARU, ION 2012-05-31 US claimed
US-20080318242-A1 METHODS AND DEVICES FOR EARLY DETECTION OF CANCER CELLS AND TYPES THROUGH MICROMECHANICAL INTERACTIONS STIHARU, ION (CA) 2008-12-25 US claimed
EP-0941738-B1 Antigenic conjugates of conserved lipooligosaccharides of gram negative bacteria WYETH CORP (US) 2005-05-11 EP claimed
US-20040052804-A1 Antigenic conjugates of conserved lipopolysaccharides of gram negative bacteria WYETH HOLDINGS CORPORATION 2004-03-18 US claimed
US-6645503-B1 Eliciting a cross reactive immune response against heterologous strains of the gram negative bacteria; vaccines; comprises the inner core and lipid A portions of the lipopolysaccharide WYETH HOLDINGS CORPORATION 2003-11-11 US claimed
US-20030129642-A1 Novel compositions and methods for inhibiting light-induced inactivation of biological reagents BIOSITE DIAGNOSTICS, INC. 2003-07-10 US claimed
EP-0701448-B1 AMPLIFICATION OF THE VITAMIN B 12 UPTAKE SYSTEM USING POLYMERS BIOTECH AUSTRALIA PTY LTD (AU) 2002-08-14 EP claimed
US-6316266-B1 PROVIDING MASS SPECTROMETRY SAMPLE PRESENTATION METAL SURFACE; CONTACTING COMPLEX WITH SURFACE TO FORM A SURFACE-BOUND COMPLEX; CONTACTING BIOMOLECULE WITH COMPLEX; APPLYING MATRIX ASSISTED LASER DESORPTION/IONIZATION MATRIX; DETERMINATION ARIZONA STATE UNIVERSITY BOARD OF REGENTS 2001-11-13 US claimed
US-6004770-A MASS SPECTROMETRY SAMPLE PRESENTATION APPARATUSES DERIVATIZED WITH COMPLEXES INCLUDING AT LEAST ONE MOLECULE WHICH MODIFIES A BIOMOLECULE ARIZONA STATE UNIVERSITY BOARD OF REGENTS (US) 1999-12-21 US claimed
EP-0941738-A1 Antigenic conjugates of conserved lipopolysaccharides of gram negative bacteria American Cyanamid Company (US) 1999-09-15 EP claimed
EP-0701448-A4 AMPLIFICATION OF THE VITAMIN B 12? UPTAKE SYSTEM USING POLYMERS BIOTECH AUSTRALIA PTY LTD (AU) 1997-01-02 EP claimed
EP-0701448-A1 AMPLIFICATION OF THE VITAMIN B 12? UPTAKE SYSTEM USING POLYMERS BIOTECH AUSTRALIA PTY. LIMITED (AU) 1996-03-20 EP claimed
US-5449720-A Amplification of the VB12 uptake system using polymers BIOTECH AUSTRALIA PTY LIMITED (AU) 1995-09-12 US claimed
WO-1994027641-A1 AMPLIFICATION OF THE VITAMIN B12 UPTAKE SYSTEM USING POLYMERS BIOTECH AUSTRALIA PTY. LIMITED (AU) 1994-12-08 WO claimed
US-12630651-B2 Anti-sclerostin constructs and uses thereof ANGITIA INCORPORATED LIMITED (US) 2026-05-19 US disclosed
WO-1994027641-A1 AMPLIFICATION OF THE VITAMIN B12 UPTAKE SYSTEM USING POLYMERS BIOTECH AUSTRALIA PTY. LIMITED (AU) 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 (2 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-12630651-B2 Anti-sclerostin constructs and uses thereof SOST, VSIR, VSIG8 HPGD 4230/4885FOLH1 1264/4885HDAC1 4640/4885
US-20040052804-A1 Antigenic conjugates of conserved lipopolysaccharides of gram negative bacteria LY96, DDOST, LRBA HPGD 2010/4885FOLH1 501/4885HDAC1 2949/4885

“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.