SCHEMBL357220

SCHEMBL357220

CSC1=CC(=O)c2ccccc2C1=O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SOAT1 P35610 13/20 1.00
S100A4 P26447 4/20 1.00
CDC25A P30304 4/20 0.57
CDC25B P30305 4/20 0.57
MAP2K7 O14733 3/20 0.57
ELANE P08246 1/20 0.57
MEN1 O00255 1/20 0.55
PLIN1 O60240 1/20 0.55
NR1I2 O75469 1/20 0.55
USP2 O75604 1/20 0.55
ALDH1A1 P00352 1/20 0.55
GSR P00390 1/20 0.55
LMNA P02545 1/20 0.55
TP53 P04637 1/20 0.55
CYP1A2 P05177 1/20 0.55
CYP3A4 P08684 1/20 0.55
ADORA3 P0DMS8 1/20 0.55
GAA P10253 1/20 0.55
CYP2D6 P10635 1/20 0.55
MAPT P10636 1/20 0.55

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
SCHEMBL13721477 0.79 SOAT1 (0.66) SOAT1S100A4CDC25ACDC25BMAP2K7
SCHEMBL18191020 0.79 SOAT1 (0.66) SOAT1S100A4CDC25ACDC25BMAP2K7
SCHEMBL4762318 0.79 SOAT1 (0.66) SOAT1S100A4CDC25ACDC25BMAP2K7
SCHEMBL29018324 0.79 SOAT1 (0.66) SOAT1S100A4CDC25ACDC25BMAP2K7
SCHEMBL2599376 0.79 SOAT1 (1.00) SOAT1S100A4CDC25ACDC25BMAP2K7
SCHEMBL17250106 0.76 SOAT1 (0.61) SOAT1S100A4CDC25ACDC25BMAP2K7
SCHEMBL7106792 0.76 SOAT1 (1.00) SOAT1S100A4CDC25ACDC25BMAP2K7
SCHEMBL9713833 0.76 SOAT1 (0.61) SOAT1S100A4CDC25ACDC25BMAP2K7
SCHEMBL2599427 0.73 SOAT1 (1.00) SOAT1S100A4CDC25ACDC25BMAP2K7
SCHEMBL15732841 0.72 SOAT1 (1.00) SOAT1S100A4CDC25ACDC25BMAP2K7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130090355-A1 CHEMICAL AGENTS FOR THE PREVENTION OF INHIBITION OR TUMOR METASTASIS ALBERT EINSTEIN COLLEGE OF MEDICINE OF YESHIVA UNIVERSITY (US) 2013-04-11 US claimed
WO-2011146101-A1 CHEMICAL AGENTS FOR THE PREVENTION OR INHIBITION OF TUMOR METASTASIS ALBERT EINSTEIN COLLEGE OF MEDICINE OF YESHIVA UNIVERSITY (US) 2011-11-24 WO claimed
CN-118697878-B Application of CD36 as molecular marker for inhibiting lung cancer meninges metastasis and therapeutic target 广东省人民医院 2025-02-11 CN disclosed
CN-118697878-A Application of CD36 as molecular marker for inhibiting lung cancer meninges metastasis and therapeutic target 广东省人民医院 2024-09-27 CN disclosed
CN-111116436-B Synthetic method of thioether compound containing 1, 4-naphthoquinone structure 信阳师范学院 2021-07-13 CN disclosed
CN-111116436-A Synthetic method of thioether compound containing 1, 4-naphthoquinone structure 信阳师范学院 2020-05-08 CN disclosed
US-10266526-B2 Substituted 1,2,3-triazoles as SMYD inhibitors for treating cancer Epizyme, Inc. (US) 2019-04-23 US disclosed
EP-3182129-B1 METHOD OF SCREENING A THERAPEUTIC AGENT FOR K-RAS MUTANT CANCER RAND BIO SCIENCE INC (KR) 2018-12-26 EP disclosed
EP-2203161-B1 QUINONE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS, AND USES THEREOF UNIV INDIANA RES & TECH CORP (US) 2018-05-09 EP disclosed
US-20170355695-A1 SMYD Inhibitors Epizyme, Inc. (US) 2017-12-14 US disclosed
EP-3182129-A1 CHEMICAL INHIBITOR OF P53-SNAIL BINDING AND PHARMACEUTICAL COMPOSITION FOR TREATING CANCER DISEASE CONTAINING SAME AS ITS ACTIVE INGREDIENT RAND Bio Science Inc. (KR) 2017-06-21 EP disclosed
EP-2203161-A1 QUINONE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS, AND USES THEREOF Indiana University Research and Technology Corporation (US) 2010-07-07 EP disclosed
US-7691418-B2 Composition for inhibiting or preventing the formation of a biofilm OYSTERSHELL NV (BE) 2010-04-06 US disclosed
WO-2009042544-A1 QUINONE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS, AND USES THEREOF INDIANA UNIVERSITY RESEARCH AND TECHNOLOGY CORPORATION (US) 2009-04-02 WO disclosed
US-20070258913-A1 Composition for Inhibiting or Preventing the Formation of a Biofilm OYSTERSHELL NV (BE) 2007-11-08 US disclosed
EP-1796656-A2 COMPOSITION FOR INHIBITING OR PREVENTING THE FORMATION OF A BIOFILM Oystershell NV (BE) 2007-06-20 EP disclosed
WO-2006029893-A2 COMPOSITION FOR INHIBITING OR PREVENTING THE FORMATION OF A BIOFILM OYSTERSHELL NV (BE) 2006-03-23 WO disclosed
WO-2005042442-A3 2-METHYLTHIO-1,4-NAPHTHOQUINONE DERIVATIVES, METHODS FOR THE PRODUCTION THEREOF, PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME, AND USE THEREOF UNIV MAINZ JOHANNES GUTENBERG (DE) 2005-07-07 WO disclosed
WO-2005042442-A2 2-METHYLTHIO-1,4-NAPHTHOQUINONE DERIVATIVES, METHODS FOR THE PRODUCTION THEREOF, PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME, AND USE THEREOF Johannes Gutenberg-Universität Mainz (DE) 2005-05-12 WO disclosed
WO-2005042442-A2 2-METHYLTHIO-1,4-NAPHTHOQUINONE DERIVATIVES, METHODS FOR THE PRODUCTION THEREOF, PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME, AND USE THEREOF Johannes Gutenberg-Universität Mainz (DE) 2005-05-12 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 (4 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-20070258913-A1 Composition for Inhibiting or Preventing the Formation of a Biofilm NQO2, NFKBIA, CROCC SOAT1 932/4885S100A4 3710/4885CDC25A 1650/4885
US-20130090355-A1 CHEMICAL AGENTS FOR THE PREVENTION OF INHIBITION OR TUMOR METASTASIS S100A4, S100A6, S100A10 SOAT1 3535/4885S100A4 1/4885CDC25A 248/4885
US-10266526-B2 Substituted 1,2,3-triazoles as SMYD inhibitors for treating cancer SMYD3, SMYD2, SNRPD3 SOAT1 362/4885S100A4 2326/4885CDC25A 2032/4885
US-20170355695-A1 SMYD Inhibitors SMYD3, SMYD2, SMURF2 SOAT1 362/4885S100A4 1831/4885CDC25A 1756/4885

“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.