SCHEMBL345558

SCHEMBL345558

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

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.52
BTN3A1 O00481 3/20 0.49
TSHR P16473 3/20 0.46
ALDH1A1 P00352 2/20 0.41
MVD P53602 2/20 0.36
POLB P06746 1/20 0.36
APEX1 P27695 1/20 0.36
HTT P42858 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
FNTA P49354 1/20 0.32
FNTB P49356 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 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
SCHEMBL29199919 0.93 THRB (0.54) THRBBTN3A1TSHRALDH1A1MVD
SCHEMBL434598 0.93 BTN3A1 (0.59) THRBBTN3A1TSHRALDH1A1MVD
SCHEMBL31091982 0.92 THRB (0.55) THRBBTN3A1TSHRALDH1A1MVD
SCHEMBL15194 0.92 THRB (0.55) THRBBTN3A1TSHRALDH1A1MVD
SCHEMBL4001460 0.91 THRB (0.47) THRBBTN3A1TSHRALDH1A1MVD
Ammonia Solution, Strong SCHEMBL18140715 0.91 THRB (0.53) THRBBTN3A1TSHRALDH1A1MVD
Phosphoric Acid SCHEMBL11307097 0.91 THRB (0.53) THRBBTN3A1TSHRALDH1A1MVD
SCHEMBL345682 0.89 TSHR (0.56) THRBBTN3A1TSHRALDH1A1MVD
SCHEMBL3447207 0.89 TSHR (0.51) THRBBTN3A1TSHRALDH1A1MVD
SCHEMBL1436153 0.88 TSHR (0.59) THRBBTN3A1TSHRALDH1A1MVD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11992538-B2 Polymerizable dental composition based on condensed silanes VOCO GMBH (DE) 2024-05-28 US claimed
US-20210052469-A1 POLYMERIZABLE DENTAL COMPOSITION BASED ON CONDENSED SILANES VOCO GMBH (DE) 2021-02-25 US claimed
EP-3782599-A1 DENTAL POLYMERIZABLE COMPOSITION BASED ON CONDENSED SILANES VOCO GmbH (DE) 2021-02-24 EP claimed
US-8329845-B2 Divided redox-curing type composition KURARAY NORITAKE DENTAL INC. (JP) 2012-12-11 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
WO-2024150826-A1 DENTAL COMPOSITION クラレノリタケデンタル株式会社 2024-07-18 WO disclosed
CN-118338879-A Curable composition for dental use 可乐丽则武齿科株式会社 2024-07-12 CN disclosed
US-20240189195-A1 DENTAL POLYMERIZABLE COMPOSITION GC CORPORATION (JP) 2024-06-13 US disclosed
US-11992538-B2 Polymerizable dental composition based on condensed silanes VOCO GMBH (DE) 2024-05-28 US disclosed
US-20030083398-A1 Dental composition kit KURARAY CO. LTD. (JP) 2003-05-01 US disclosed
US-20030064102-A1 Antimicrobial Composition NAKATSUKA KAZUMITSU (JP) 2003-04-03 US disclosed
EP-1285947-A1 ANTIMICROBIAL COMPOSITION KURARAY CO., LTD. (JP) 2003-02-26 EP disclosed
EP-1269968-A1 Dental cement composition KURARAY CO., LTD. (JP) 2003-01-02 EP disclosed
EP-1269967-A1 Dental composition kit KURARAY CO., LTD. (JP) 2003-01-02 EP disclosed
US-20020198284-A1 Adhesive composition KURARAY CO. LTD, (JP) 2002-12-26 US disclosed
EP-1262530-A1 ADHESIVE COMPOSITION KURARAY CO., LTD. (JP) 2002-12-04 EP disclosed
US-4292235-A WATERPROOFING, METHYL METHACRYLATE COPOLYMER, PENTAVALENT PHOSPHORUS COMPOUND MITSUI TOATSU CHEMICALS, INC. (JP) 1981-09-29 US 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-11992538-B2 Polymerizable dental composition based on condensed silanes NCAPH, RCC1, NCAPD2 THRB 4522/4885BTN3A1 240/4885TSHR 4596/4885
US-20250122315-A1 (METH)ACRYLATE AND USE THEREOF TST, MMAB, BHMT2 THRB 1006/4885BTN3A1 1557/4885TSHR 2952/4885
US-12441821-B2 (Meth)acrylate and use thereof TST, MMAB, BHMT2 THRB 1006/4885BTN3A1 1557/4885TSHR 2952/4885
US-20030064102-A1 Antimicrobial Composition AAAS, H1-0, H1-10 THRB 3108/4885BTN3A1 1445/4885TSHR 4699/4885
US-20210052469-A1 POLYMERIZABLE DENTAL COMPOSITION BASED ON CONDENSED SILANES NCAPH, RCC1, NCAPD2 THRB 4522/4885BTN3A1 240/4885TSHR 4596/4885

“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.