SCHEMBL6791402

SCHEMBL6791402

C=CC(=O)OC(CCCC)OP(=O)(OC(CCCC)OC(=O)C=C)OC(CCCC)OC(=O)C=C

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.46
HPGD P15428 1/20 0.43
SMPD1 P17405 3/20 0.41
FDPS P14324 1/20 0.35
THRB P10828 3/20 0.35
CYP3A4 P08684 2/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
THRA P10827 1/20 0.32
CTSK P43235 3/20 0.32
LMNA P02545 2/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
ALDH1A1 P00352 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
SCHEMBL6783957 0.95 SMPD1 (0.47) TSHRHPGDSMPD1FDPSTHRB
SCHEMBL22471725 0.94 SMPD1 (0.50) TSHRHPGDSMPD1FDPSTHRB
SCHEMBL22471728 0.94 SMPD1 (0.50) TSHRHPGDSMPD1FDPSTHRB
SCHEMBL22471720 0.94 SMPD1 (0.50) TSHRHPGDSMPD1FDPSTHRB
SCHEMBL22471727 0.94 SMPD1 (0.50) TSHRHPGDSMPD1FDPSTHRB
SCHEMBL6790631 0.90 TSHR (0.38) TSHRHPGDSMPD1FDPSTHRB
SCHEMBL28245219 0.89 TSHR (0.45) TSHRHPGDSMPD1FDPSTHRB
SCHEMBL6791410 0.89 SMPD1 (0.56) TSHRHPGDSMPD1FDPSTHRB
SCHEMBL28865008 0.88 TSHR (0.44) TSHRHPGDSMPD1FDPSTHRB
SCHEMBL9578994 0.86 TSHR (0.54) TSHRHPGDSMPD1THRBCYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4682939-A1 POLISHING COMPOSITION, CONCENTRATED LIQUID OF POLISHING COMPOSITION, AND POLISHING METHOD Fujimi Incorporated (JP) 2026-01-21 EP disclosed
CN-119816285-A Dental caries tooth restoration agent and dental adhesive material kit 可乐丽则武齿科株式会社 2025-04-11 CN disclosed
CN-119768146-A Adhesive composition for dental use 可乐丽则武齿科株式会社 2025-04-04 CN disclosed
WO-2025069725-A1 POLISHING COMPOSITION, CONCENTRATED SOLUTION OF POLISHING COMPOSITION, AND POLISHING METHOD 株式会社フジミインコーポレーテッド 2025-04-03 WO disclosed
CN-111743782-B Powder-liquid type dental resin reinforced glass ion water-gate composition 株式会社松风 2025-01-07 CN disclosed
CN-119074563-A Dental curable composition containing ultraviolet absorber 株式会社松风 2024-12-06 CN disclosed
CN-113402665-B Dental photocurable composition comprising a highly soluble photoacid generator 株式会社松风 2024-11-15 CN disclosed
CN-113402666-B Dental photocurable composition excellent in color tone selectivity 株式会社松风 2024-11-15 CN disclosed
CN-113179629-B Dental cleaning material and temporary dental adhesive material removing material 可乐丽则武齿科株式会社 2024-09-17 CN disclosed
CN-118414136-A Curable composition for dental use 可乐丽则武齿科株式会社 2024-07-30 CN disclosed
CN-117157263-A Zirconia compact, zirconia calcined body, zirconia sintered body, and methods for producing these 可乐丽则武齿科株式会社 2023-12-01 CN disclosed
CN-116916872-A Dental composition 可乐丽则武齿科株式会社 2023-10-20 CN disclosed
CN-113490468-B Zirconia compact and calcined compact which can be fired in a short time 可乐丽则武齿科株式会社 2023-09-05 CN disclosed
CN-111050731-B Non-solvent dental adhesive composition 可乐丽则武齿科株式会社 2023-06-20 CN disclosed
CN-110785159-B Dual paste type curable dental composition 可乐丽则武齿科株式会社 2023-06-09 CN disclosed
CN-111225647-B Dental composition 可乐丽则武齿科株式会社 2023-02-28 CN disclosed
CN-115703207-A Surface treatment method, method for manufacturing semiconductor substrate, surface treatment composition, and system for manufacturing semiconductor substrate 福吉米株式会社 2023-02-17 CN disclosed
CN-115068345-A Dental adhesive composition having excellent storage stability 株式会社松风 2022-09-20 CN disclosed
WO-2020194978-A1 SURFACE TREATMENT COMPOSITION, METHOD FOR MANUFACTURING SAME, SURFACE TREATMENT METHOD, AND METHOD FOR MANUFACTURING SEMICONDUCTOR SUBSTRATE 株式会社フジミインコーポレーテッド 2020-10-01 WO disclosed
US-20040259992-A1 Two-component adhesion promoter combination of an unsaturated alkoxysilane and a mercaptoalkyl alkoxysilane, for use in dental prostheses 3M ESPE AG (DE) 2004-12-23 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 (1 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-20040259992-A1 Two-component adhesion promoter combination of an unsaturated alkoxysilane and a mercaptoalkyl alkoxysilane, for use in dental prostheses ITGA2, ITGB2, ITGA2B TSHR 3882/4885HPGD 996/4885SMPD1 3800/4885

“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.