SCHEMBL1367365

SCHEMBL1367365

CCOc1ccc(C(=O)C(=O)c2ccc(OCC)cc2)cc1

nearest known ligand 0.70

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PARP10 Q53GL7 1/20 0.70
NPC1 O15118 2/20 0.66
PLK1 P53350 1/20 0.66
NQO1 P15559 1/20 0.64
NPSR1 Q6W5P4 2/20 0.61
PLA2G4B P0C869 1/20 0.61
KMT2A Q03164 1/20 0.61
ALDH1A1 P00352 3/20 0.59
RAB9A P51151 1/20 0.59
PRSS1 P07477 1/20 0.59
PRSS2 P07478 1/20 0.59
PRSS3 P35030 1/20 0.59
CES2 O00748 1/20 0.58
CES1 P23141 1/20 0.58
HPGD P15428 3/20 0.58
KDM4E B2RXH2 1/20 0.58
L3MBTL1 Q9Y468 1/20 0.58
HSD17B10 Q99714 1/20 0.56

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
SCHEMBL460957 0.92 CES2 (0.63) PARP10NPC1PLK1NPSR1PLA2G4B
SCHEMBL11234780 0.92 CES2 (0.73) PARP10NPC1PLK1NQO1NPSR1
SCHEMBL13268807 0.92 LTA4H (0.66) PARP10NPC1PLK1NQO1NPSR1
SCHEMBL9728442 0.92 CES2 (0.73) PARP10NPC1PLK1NQO1NPSR1
SCHEMBL28418500 0.92 MAOB (0.62) PARP10NPC1PLK1NQO1NPSR1
SCHEMBL8341465 0.90 PTPRC (0.65) PARP10NPC1PLK1NQO1NPSR1
SCHEMBL845348 0.86 NPSR1 (0.79) PARP10NPC1PLK1NQO1NPSR1
SCHEMBL11430643 0.86 PARP10 (0.59) PARP10NPC1PLK1NQO1NPSR1
SCHEMBL3096652 0.86 PARP10 (0.59) PARP10NPC1PLK1NQO1NPSR1
SCHEMBL18790798 0.86 NPC1 (0.69) PARP10NPC1PLK1NQO1NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11844847-B2 Sulfur-containing polymerizable monomer and use thereof SUN MEDICAL CO., LTD. (JP) 2023-12-19 US disclosed
EP-3278787-B1 POLYMERIZABLE MONOMER FOR DENTAL MATERIALS, COMPOSITION, ADHESIVE DENTAL MATERIAL, AND KIT MITSUI CHEMICALS INC (JP) 2022-03-23 EP disclosed
US-20210298997-A1 SULFUR-CONTAINING POLYMERIZABLE MONOMER AND USE THEREOF SUN MEDICAL CO., LTD. (JP) 2021-09-30 US disclosed
US-11110038-B2 Dental polymerizable monomers, compositions, adhesive dental materials and kits MITSUI CHEMICALS, INC. (JP) 2021-09-07 US disclosed
EP-3835289-A1 SULFUR-CONTAINING POLYMERIZABLE MONOMER AND USE THEREOF Sun Medical Co., Ltd. (JP) 2021-06-16 EP disclosed
US-20200030194-A1 DENTAL POLYMERIZABLE MONOMERS, COMPOSITIONS, ADHESIVE DENTAL MATERIALS AND KITS MITSUI CHEMICALS, INC. (JP) 2020-01-30 US disclosed
US-10470980-B2 Dental polymerizable monomers, compositions, adhesive dental materials and kits MITSUI CHEMICALS, INC. (JP) 2019-11-12 US disclosed
US-20180110683-A1 DENTAL POLYMERIZABLE MONOMERS, COMPOSITIONS, ADHESIVE DENTAL MATERIALS AND KITS MITSUI CHEMICALS, INC. (JP) 2018-04-26 US disclosed
EP-3278787-A1 POLYMERIZABLE MONOMER FOR DENTAL MATERIALS, COMPOSITION, ADHESIVE DENTAL MATERIAL, AND KIT Mitsui Chemicals, Inc. (JP) 2018-02-07 EP disclosed
US-8546459-B2 Dental filling/restoration kit TOKUYAMA DENTAL CORPORATION (JP) 2013-10-01 US disclosed
US-20100292359-A1 Reaction-Curable Adhesive Composition and Dental Adhesive Kit SUN MEDICAL CO., LTD. (JP) 2010-11-18 US disclosed
EP-2156817-A1 REACTION-SETTING ADHESIVE COMPOSITION, AND ADHESIVE MATERIAL KIT FOR DENTAL APPLICATIONS SUN MEDICAL CO., LTD. (JP) 2010-02-24 EP disclosed
EP-0778209-B1 Oxygen absorbing container TOYO SEIKAN KAISHA LTD (JP) 1998-09-09 EP disclosed
EP-0778209-A1 Oxygen absorbing container TOYO SEIKAN KAISHA LIMITED (JP) 1997-06-11 EP disclosed
US-RE35135-E Dental material; mixture of radical-polymerizable monomer, alpha-ketocarbonyl and aromatic amine MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1995-12-26 US disclosed
EP-0535828-A1 Photostereolithographic process ZENECA LIMITED (GB) 1993-04-07 EP disclosed
US-4992351-A Recording medium having a specified photopolymerization initiator CANON KABUSHIKI KAISHA (JP) 1991-02-12 US disclosed
EP-0136186-B1 PHOTOCURABLE RESIN COMPOSITION MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1989-09-06 EP disclosed
US-4548689-A RADICAL POLYMERIZABLE MONOMER, KETOCARBONYL COMPOUND AND MERCAPTOB MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1985-10-22 US disclosed
EP-0136186-A2 Photocurable resin composition MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1985-04-03 EP 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 (6 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-20200030194-A1 DENTAL POLYMERIZABLE MONOMERS, COMPOSITIONS, ADHESIVE DENTAL MATERIALS AND KITS ACTN1, SMCHD1, CAPZA1 PARP10 3062/4885NPC1 4854/4885PLK1 4345/4885
US-10470980-B2 Dental polymerizable monomers, compositions, adhesive dental materials and kits HRH3, HRH1, HRH2 PARP10 1059/4885NPC1 4520/4885PLK1 4882/4885
US-20210298997-A1 SULFUR-CONTAINING POLYMERIZABLE MONOMER AND USE THEREOF MGMT, SETDB1, ASH2L PARP10 218/4885NPC1 4797/4885PLK1 3079/4885
US-11844847-B2 Sulfur-containing polymerizable monomer and use thereof MGMT, SETDB1, ASH2L PARP10 218/4885NPC1 4797/4885PLK1 3079/4885
US-11110038-B2 Dental polymerizable monomers, compositions, adhesive dental materials and kits ACTN1, SMCHD1, CAPZA1 PARP10 3062/4885NPC1 4854/4885PLK1 4345/4885
US-20180110683-A1 DENTAL POLYMERIZABLE MONOMERS, COMPOSITIONS, ADHESIVE DENTAL MATERIALS AND KITS HRH3, HRH1, HRH2 PARP10 1059/4885NPC1 4520/4885PLK1 4882/4885

“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.