SCHEMBL786236

SCHEMBL786236

C=CC(=O)OCn1c(=O)n(COC(=O)C=C)c(=O)n(COC(=O)C=C)c1=O

nearest known ligand 0.45

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.45
ALDH1A1 P00352 6/20 0.45
TP53 P04637 3/20 0.45
HIF1A Q16665 3/20 0.45
CYP3A4 P08684 3/20 0.45
HSD17B10 Q99714 1/20 0.45
MAPK1 P28482 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
HPGD P15428 1/20 0.41
THRB P10828 3/20 0.38

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
SCHEMBL18116566 0.88 TSHR (0.42) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL25644164 0.83 ALDH1A1 (0.34) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL28638915 0.81 TSHR (0.38) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL42549 0.79 TSHR (0.52) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL21816726 0.79 TSHR (0.38) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL5269389 0.76 TSHR (0.59) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL21517646 0.76 APEX1 (0.37) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL19117419 0.76 ALDH1A1 (0.50) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL21271474 0.75 GSTP1 (0.41) ALDH1A1
SCHEMBL8747671 0.75 ALDH1A1 (0.53) TSHRALDH1A1TP53HIF1ACYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115260112-A Sexek derivative and preparation method and application thereof 佳化化学科技发展(上海)有限公司 2022-11-01 CN disclosed
US-11424482-B2 Nonaqueous electrolyte solution and nonaqueous electrolyte battery using same MITSUBISHI CHEMICAL CORPORATION (JP) 2022-08-23 US disclosed
US-11296357-B2 Non-aqueous electrolytic solution and non-aqueous electrolyte secondary battery using the same MITSUBISHI CHEMICAL CORPORATION (JP) 2022-04-05 US disclosed
CN-109562989-B Optical fiber and method for manufacturing optical fiber 住友电气工业株式会社 2021-10-26 CN disclosed
US-20210020991-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND NONAQUEOUS ELECTROLYTE BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2021-01-21 US disclosed
US-10615455-B2 Non-aqueous electrolytic solution and non-aqueous electrolyte secondary battery using the same MITSUBISHI CHEMICAL CORPORATION (JP) 2020-04-07 US disclosed
US-20200036041-A1 NON-AQUEOUS ELECTROLYTIC SOLUTION AND NON-AQUEOUS ELECTROLYTE SECONDARY BATTERY USING THE SAME MITSUBISHI CHEMICAL CORPORATION (JP) 2020-01-30 US disclosed
US-20190334208-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND NONAQUEOUS ELECTROLYTE BATTERY USING SAME MITSUBISHI CHEMICAL CORPORATION (JP) 2019-10-31 US disclosed
US-10451796-B2 Optical fiber and method for producing optical fiber SUMITOMO ELECTRIC INDUSTRIES, LTD. (JP) 2019-10-22 US disclosed
US-10424812-B2 Non-aqueous electrolytic solution and non-aqueous electrolyte secondary battery using the same MITSUBISHI CHEMICAL CORPORATION (JP) 2019-09-24 US disclosed
US-6787197-B1 Method for producing scratch resistant, weatherproof coatings BASF AKTIENGESELLSCHAFT (DE) 2004-09-07 US disclosed
US-20040018367-A1 Method for producing a curable aqueous polymer dispersion BASF AKTIENGESELLSCHAFT (DE) 2004-01-29 US disclosed
US-6668122-B2 Comprising quartz glass fiber, primary coating and secondary coating formed by curing resin composition comprising polyurethane (meth)acrylate oligomer; minimized transmission loss SHIN-ETSU CHEMICAL CO., LTD. (JP) 2003-12-23 US disclosed
US-6602929-B1 Reaction product of a polyether having a (meth)acryloyl group and a hydroxyl group at opposite ends with a diisocyante; Upon curing, it forms a coating having a minimized water absorption on the optical fiber SHIN-ETSU CHEMICAL CO., LTD. (JP) 2003-08-05 US disclosed
US-20020183411-A1 Electron-beam curable composition comprising polyurethane and thiazole, imidazole, and/or thiourea compound; minimal gelling and tensile strength; uniformity SHIN-ETSU CHEMICAL CO., LTD. (JP) 2002-12-05 US disclosed
US-20020159737-A1 Coated optical fiber SHIN-ETSU CHEMICAL CO., LTD. (JP) 2002-10-31 US disclosed
EP-1231190-A1 Coated optical fiber SHIN-ETSU CHEMICAL CO., LTD. (JP) 2002-08-14 EP disclosed
US-6198867-B1 POLYSILOXANE ENDCAPPED WITH (METH)ACRYL GROUP, AND CONTAINING AROMATIC HYDROCARBON GROUPS ATTACHED TO SILICON ATOMS, AN UNSATURATED COMPOUND, AND A PHOTOPOLYMERIZATION CATALYST; LOW VISCOSITY, CURES TO A LOW YOUNG'S MODULUS COATING SHIN-ETSU CHEMICAL CO., LTD. (JP) 2001-03-06 US disclosed
EP-1046619-A2 Coated optical fibres and their manufacture SHIN-ETSU CHEMICAL CO., LTD. (JP) 2000-10-25 EP disclosed
EP-0970978-A1 Radiation-curable liquid resin composition suitable for coating optical fibers and optical fiber coated therewith SHIN-ETSU CHEMICAL CO., LTD. (JP) 2000-01-12 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 (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-20210020991-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND NONAQUEOUS ELECTROLYTE BATTERY SLC9B2, SLC9A1, SLC9A2 TSHR 4689/4885ALDH1A1 3675/4885TP53 4229/4885

“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.