SCHEMBL2356791

SCHEMBL2356791

C=C(P(=O)(OCC)OCC)P(=O)(OCC)OCC

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.48
CA12 O43570 1/20 0.45
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
CA9 Q16790 1/20 0.45
TP53 P04637 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
PPARD Q03181 2/20 0.42
NR1I2 O75469 1/20 0.39
HMGCR P04035 1/20 0.35

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
SCHEMBL10395233 0.91 TSHR (0.40) TSHRCA12CA1CA2CA9
SCHEMBL10394481 0.91 TSHR (0.40) TSHRCA12CA1CA2CA9
SCHEMBL15981078 0.89 TSHR (0.39) TSHRCA12CA1CA2CA9
SCHEMBL10395235 0.89 CA12 (0.42) TSHRCA12CA1CA2CA9
SCHEMBL10395211 0.89 CA12 (0.42) TSHRCA12CA1CA2CA9
SCHEMBL8912967 0.85 TSHR (0.40) TSHRCA12CA1CA2CA9
SCHEMBL10394487 0.85 TSHR (0.40) TSHRCA12CA1CA2CA9
SCHEMBL10395210 0.85 CA12 (0.36) TSHRCA12CA1CA2CA9
SCHEMBL10395700 0.85 CYP3A4 (0.50) TSHRCA12CA1CA2CA9
SCHEMBL10395314 0.85 CYP3A4 (0.50) TSHRCA12CA1CA2CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109910406-A Non-woven fabric for automotive interior and preparation method thereof 朱建余 2019-06-21 CN claimed
US-4820698-A TETRAALKYL ETHENYLIDENEBISPHOSPHONATES THE PROCTER & GAMBLE COMPANY (US) 1989-04-11 US claimed
EP-0221611-A2 Antimicrobial agents and process for their manufacture THE PROCTER & GAMBLE COMPANY (US) 1987-05-13 EP claimed
JP-9202794-A None JP disclosed
US-12595229-B2 Method for producing derivative of organic substance and method for analyzing sample containing organic substance AJINOMOTO CO., INC. (JP) 2026-04-07 US disclosed
US-20220267264-A1 METHOD FOR PRODUCING DERIVATIVE OF ORGANIC SUBSTANCE AND METHOD FOR ANALYZING SAMPLE CONTAINING ORGANIC SUBSTANCE AJINOMOTO CO., INC. (JP) 2022-08-25 US disclosed
US-20220002576-A1 GAS-ACTIVATED CYANOACRYLATES FOR 3-D PRINTING HENKEL AG & CO KGAA (DE) 2022-01-06 US disclosed
US-RE48510-E1 Phosphorus functional antimicrobial coatings for metal surfaces NANO SAFE COATINGS INCORPORATED (US) 2021-04-13 US disclosed
WO-2020187548-A1 GAS-ACTIVATED CYANOACRYLATES FOR 3D-PRINTING HENKEL AG & CO. KGAA (DE) 2020-09-24 WO disclosed
EP-3708370-A1 3D-PRINTING METHOD USING GAS-ACTIVATED CYANOACRYLATES Henkel AG & Co. KGaA (DE) 2020-09-16 EP disclosed
EP-3235822-B1 NOVEL BISPHOSPHONIC ACID DERIVATIVE AND APPLICATION FOR SAME UNIV NAGASAKI (JP) 2020-01-29 EP disclosed
EP-0321233-A1 Oral compositions THE PROCTER & GAMBLE COMPANY (US) 1989-06-21 EP disclosed
US-4820698-A TETRAALKYL ETHENYLIDENEBISPHOSPHONATES THE PROCTER & GAMBLE COMPANY (US) 1989-04-11 US disclosed
EP-0230068-A2 Use of a geminal diphosphonic acid compound to prepare a medicament Norwich Eaton Pharmaceuticals, Inc. (US) 1987-07-29 EP disclosed
EP-0221611-A2 Antimicrobial agents and process for their manufacture THE PROCTER & GAMBLE COMPANY (US) 1987-05-13 EP disclosed
EP-0186405-A2 Pharmaceutical compositions containing geminal diphosphonates THE PROCTER & GAMBLE COMPANY (US) 1986-07-02 EP disclosed
EP-0068584-B1 BORON CONTAINING POLYPHOSPHONATES FOR THE TREATMENT OF CALCIFIC TUMORS THE PROCTER & GAMBLE COMPANY (US) 1985-09-25 EP disclosed
US-4399817-A Boron containing polyphosphonates for the treatment of calcific tumors THE PROCTER & GAMBLE COMPANY (US) 1983-08-23 US disclosed
EP-0068584-A1 Boron containing polyphosphonates for the treatment of calcific tumors THE PROCTER & GAMBLE COMPANY (US) 1983-01-05 EP disclosed
US-4246103-A INHIBIT PRECIPITATION OF HARD WATER IONS ESPECIALLY FOR INDUSTRIAL WATER AND SLUDGE BAYER AKTIENGESELLSCHAFT (DE) 1981-01-20 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 (2 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-12595229-B2 Method for producing derivative of organic substance and method for analyzing sample containing organic substance SULT1E1, CNR2, SRMS TSHR 2375/4885CA12 1482/4885CA1 1758/4885
US-20220267264-A1 METHOD FOR PRODUCING DERIVATIVE OF ORGANIC SUBSTANCE AND METHOD FOR ANALYZING SAMPLE CONTAINING ORGANIC SUBSTANCE SORD, STS, SULT2A1 TSHR 2969/4885CA12 3759/4885CA1 3917/4885

“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.