SCHEMBL3267476

SCHEMBL3267476

C=CC(=O)OCCCCCCCCCCC(C(=O)O)C(=O)O

nearest known ligand 0.70

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.70
ALDH1A1 P00352 4/20 0.70
CYP3A4 P08684 2/20 0.70
HPGD P15428 1/20 0.53
TP53 P04637 3/20 0.48
HIF1A Q16665 3/20 0.48
HSD17B10 Q99714 1/20 0.48
THRB P10828 2/20 0.41
MAPK1 P28482 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
HCAR2 Q8TDS4 3/20 0.40
ATM Q13315 1/20 0.34
HTT P42858 1/20 0.33
L3MBTL1 Q9Y468 2/20 0.32
MAPT P10636 1/20 0.32
TBXAS1 P24557 1/20 0.32

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
SCHEMBL9060209 0.84 TSHR (0.56) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL13283404 0.84 TSHR (1.00) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL33725 0.84 TSHR (1.00) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL3503091 0.84 TSHR (1.00) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL8493780 0.84 TSHR (1.00) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL322713 0.84 TSHR (1.00) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL482460 0.84 TSHR (1.00) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL9101988 0.84 TSHR (1.00) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL20873747 0.84 TSHR (1.00) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL13945622 0.84 TSHR (1.00) TSHRALDH1A1CYP3A4HPGDTP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4331558-A1 BIOCOMPATIBLE MELT-DENTIN SINGLE COMPONENT ADHESIVES Ivoclar Vivadent AG (LI) 2024-03-06 EP claimed
CN-117618255-A Biocompatible enamel-dentin single component adhesive 义获嘉伟瓦登特公司 2024-03-01 CN claimed
US-20240065944-A1 Biocompatible Enamel-Dentin Single-Component Adhesives IVOCLAR VIVADENT AG (LI) 2024-02-29 US claimed
US-12441821-B2 (Meth)acrylate and use thereof MITSUI CHEMICALS, INC. (JP) 2025-10-14 US disclosed
US-20250122315-A1 (METH)ACRYLATE AND USE THEREOF MITSUI CHEMICALS, INC. (JP) 2025-04-17 US disclosed
EP-3719043-B1 (METH)ACRYLATE, MONOMER COMPOSITION, DENTAL MATERIAL OBTAINED FROM SAID COMPOSITION, AND PRODUCTION METHOD THEREOF MITSUI CHEMICALS INC (JP) 2024-11-13 EP disclosed
EP-3603606-B1 ADHESIVE MONOMER FOR DENTAL MATERIAL MITSUI CHEMICALS INC (JP) 2024-11-13 EP disclosed
EP-4331558-A1 BIOCOMPATIBLE MELT-DENTIN SINGLE COMPONENT ADHESIVES Ivoclar Vivadent AG (LI) 2024-03-06 EP disclosed
CN-117618255-A Biocompatible enamel-dentin single component adhesive 义获嘉伟瓦登特公司 2024-03-01 CN disclosed
US-20240065944-A1 Biocompatible Enamel-Dentin Single-Component Adhesives IVOCLAR VIVADENT AG (LI) 2024-02-29 US disclosed
EP-3604318-B1 PHOSPHORUS-CONTAINING COMPOUND MITSUI CHEMICALS INC (JP) 2024-01-17 EP 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-20170181932-A1 DENTAL POLYMERIZABLE MONOMER COMPOSITIONS MITSUI CHEMICALS, INC. (JP) 2017-06-29 US disclosed
US-20170174621-A1 DENTAL POLYMERIZABLE MONOMERS MITSUI CHEMICALS, INC. (JP) 2017-06-22 US disclosed
EP-3135271-A1 POLYMERIZABLE MONOMER COMPOSITION FOR DENTAL MATERIAL Mitsui Chemicals, Inc. (JP) 2017-03-01 EP disclosed
EP-3135270-A1 POLYMERIZABLE MONOMER FOR DENTAL MATERIAL Mitsui Chemicals, Inc. (JP) 2017-03-01 EP disclosed
EP-0694298-B1 PREFORMED GLASS IONOMER FILLER WHICH CAN SUSTAINEDLY RELEASE FLUORIDE ION AND DENTAL COMPOSITION CONTAINING THE SAME SHOFU INC (JP) 2010-06-09 EP disclosed
US-5883153-A SUSTAINED RELEASE GLASS IONOMERS SHOFU INC. (JP) 1999-03-16 US disclosed
EP-0694298-A1 PREFORMED GLASS IONOMER FILLER WHICH CAN SUSTAINEDLY RELEASE FLUORIDE ION AND DENTAL COMPOSITION CONTAINING THE SAME SHOFU INC. (JP) 1996-01-31 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 (5 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-20170181932-A1 DENTAL POLYMERIZABLE MONOMER COMPOSITIONS CAD, SMCHD1, ACR TSHR 4078/4885ALDH1A1 274/4885CYP3A4 1666/4885
US-20250122315-A1 (METH)ACRYLATE AND USE THEREOF TST, MMAB, BHMT2 TSHR 2952/4885ALDH1A1 144/4885CYP3A4 548/4885
US-12441821-B2 (Meth)acrylate and use thereof TST, MMAB, BHMT2 TSHR 2952/4885ALDH1A1 144/4885CYP3A4 548/4885
US-20170174621-A1 DENTAL POLYMERIZABLE MONOMERS CAD, SMCHD1, SDAD1 TSHR 4774/4885ALDH1A1 357/4885CYP3A4 2556/4885
US-20180110683-A1 DENTAL POLYMERIZABLE MONOMERS, COMPOSITIONS, ADHESIVE DENTAL MATERIALS AND KITS HRH3, HRH1, HRH2 TSHR 861/4885ALDH1A1 394/4885CYP3A4 3277/4885

“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.