SCHEMBL18544293

SCHEMBL18544293

C=CC(=O)OCCOP(=O)(O)OP(=O)(O)OCCOC(=O)C=C

nearest known ligand 0.55

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.55
ALDH1A1 P00352 4/20 0.55
TP53 P04637 3/20 0.55
HIF1A Q16665 3/20 0.55
HSD17B10 Q99714 1/20 0.55
CYP3A4 P08684 2/20 0.50
HPGD P15428 1/20 0.46
THRB P10828 2/20 0.42
BTN3A1 O00481 2/20 0.38
MAPK1 P28482 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
MVD P53602 3/20 0.35
LPAR2 Q9HBW0 1/20 0.32
LPAR3 Q9UBY5 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
SCHEMBL631228 0.93 TSHR (0.52) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL1068090 0.92 TSHR (0.59) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL7551686 0.87 TSHR (0.70) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL7551992 0.87 TSHR (0.70) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL28433337 0.87 TSHR (0.53) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL24359828 0.85 TSHR (0.62) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL3273860 0.85 TSHR (0.52) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL40905 0.84 TSHR (0.59) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL3412968 0.84 TSHR (0.55) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL3275277 0.84 TSHR (0.50) TSHRALDH1A1TP53HIF1AHSD17B10

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-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-3604318-B1 PHOSPHORUS-CONTAINING COMPOUND MITSUI CHEMICALS INC (JP) 2024-01-17 EP disclosed
US-11786444-B2 Dental polyfunctional monomers and dental hydroxyl group-containing monomers MITSUI CHEMICALS, INC. (JP) 2023-10-17 US disclosed
EP-3603607-B1 MULTIFUNCTIONAL MONOMER FOR DENTAL MATERIAL, AND HYDROXYL GROUP-CONTAINING MONOMER FOR DENTAL MATERIAL MITSUI CHEMICALS INC (JP) 2023-09-20 EP disclosed
US-11407846-B2 (Meth)acrylate, monomer composition, dental material obtained from composition, and production method thereof MITSUI CHEMICALS, INC. (JP) 2022-08-09 US disclosed
US-11406571-B2 Dental polyfunctional monomers and dental hydroxyl group-containing monomers MITSUI CHEMICALS, INC. (JP) 2022-08-09 US disclosed
US-11311462-B2 Adhesive monomers for dental materials MITSUI CHEMICALS, INC. (JP) 2022-04-26 US disclosed
US-10470980-B2 Dental polymerizable monomers, compositions, adhesive dental materials and kits MITSUI CHEMICALS, INC. (JP) 2019-11-12 US disclosed
EP-3135271-B1 POLYMERIZABLE MONOMER COMPOSITION FOR DENTAL MATERIAL MITSUI CHEMICALS INC (JP) 2019-05-08 EP disclosed
US-10130563-B2 Dental polymerizable monomer compositions MITSUI CHEMICALS, INC. (JP) 2018-11-20 US disclosed
US-10130564-B2 Dental polymerizable monomers MITSUI CHEMICALS, INC. (JP) 2018-11-20 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-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-3135270-A1 POLYMERIZABLE MONOMER FOR DENTAL MATERIAL Mitsui Chemicals, Inc. (JP) 2017-03-01 EP disclosed
EP-3135271-A1 POLYMERIZABLE MONOMER COMPOSITION FOR DENTAL MATERIAL Mitsui Chemicals, Inc. (JP) 2017-03-01 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 (12 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-10130564-B2 Dental polymerizable monomers CAD, SMCHD1, SDAD1 TSHR 4774/4885ALDH1A1 357/4885TP53 3960/4885
US-10470980-B2 Dental polymerizable monomers, compositions, adhesive dental materials and kits HRH3, HRH1, HRH2 TSHR 861/4885ALDH1A1 394/4885TP53 3656/4885
US-10130563-B2 Dental polymerizable monomer compositions CAD, SMCHD1, ACR TSHR 4078/4885ALDH1A1 274/4885TP53 3927/4885
US-20170181932-A1 DENTAL POLYMERIZABLE MONOMER COMPOSITIONS CAD, SMCHD1, ACR TSHR 4078/4885ALDH1A1 274/4885TP53 3927/4885
US-11786444-B2 Dental polyfunctional monomers and dental hydroxyl group-containing monomers PAM, CAD, FHIT TSHR 2948/4885ALDH1A1 1173/4885TP53 2612/4885
US-20250122315-A1 (METH)ACRYLATE AND USE THEREOF TST, MMAB, BHMT2 TSHR 2952/4885ALDH1A1 144/4885TP53 2409/4885
US-11406571-B2 Dental polyfunctional monomers and dental hydroxyl group-containing monomers PAM, CAD, FHIT TSHR 2948/4885ALDH1A1 1173/4885TP53 2612/4885
US-12441821-B2 (Meth)acrylate and use thereof TST, MMAB, BHMT2 TSHR 2952/4885ALDH1A1 144/4885TP53 2409/4885
US-11311462-B2 Adhesive monomers for dental materials COL1A1, CDH1, GJA1 TSHR 4250/4885ALDH1A1 836/4885TP53 3501/4885
US-11407846-B2 (Meth)acrylate, monomer composition, dental material obtained from composition, and production method thereof ACR, ICMT, TST TSHR 2609/4885ALDH1A1 1065/4885TP53 2622/4885
US-20170174621-A1 DENTAL POLYMERIZABLE MONOMERS CAD, SMCHD1, SDAD1 TSHR 4774/4885ALDH1A1 357/4885TP53 3960/4885
US-20180110683-A1 DENTAL POLYMERIZABLE MONOMERS, COMPOSITIONS, ADHESIVE DENTAL MATERIALS AND KITS HRH3, HRH1, HRH2 TSHR 861/4885ALDH1A1 394/4885TP53 3656/4885

“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.