SCHEMBL3545919

SCHEMBL3545919

C1CCC(C23CCCCC2O3)CC1

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.31
TSHR P16473 1/20 0.31
CHRM2 P08172 1/20 0.30
CHRM4 P08173 1/20 0.30
CHRM5 P08912 1/20 0.30
CHRM1 P11229 1/20 0.30
CHRM3 P20309 1/20 0.30

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
SCHEMBL9645463 1.00 LMNA (0.31) LMNATSHRCHRM2CHRM4CHRM5
SCHEMBL29521328 0.93
SCHEMBL9351330 0.88
SCHEMBL9351569 0.88
SCHEMBL9091676 0.83
SCHEMBL28809766 0.78
SCHEMBL11954724 0.76
SCHEMBL11954723 0.76
SCHEMBL14679 0.76
SCHEMBL11894948 0.76

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101087772-B High-purity alicyclic diepoxy compound and preparation method thereof DAICEL CHEM 2012-05-09 CN disclosed
US-7732627-B2 High-purity cycloaliphatic diepoxy compound and preparation process thereof DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2010-06-08 US disclosed
US-20080045729-A1 High-Purity Cycloaliphatic Diepoxy Compound and Preparation Process Thereof DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2008-02-21 US disclosed
CN-101087772-A High-purity alicyclic diepoxy compound and preparation method thereof DAICEL CHEM (JP) 2007-12-12 CN disclosed
EP-1834949-A1 HIGH-PURITY ALICYCLIC DIEPOXY COMPOUND AND PROCESS FOR PRODUCING THE SAME Daicel Chemical Industries, Ltd. (JP) 2007-09-19 EP disclosed
EP-0176991-B1 COMPOSITION AND METHOD FOR CORROSION INHIBITION PHILLIPS PETROLEUM COMPANY (US) 1990-09-12 EP disclosed
US-4664193-A BEAT-HYDROXYTHIOETHER OR BETA-ALKOXYTHIOETHER PHILLIPS PETROLEUM COMPANY (US) 1987-05-12 US disclosed
US-4650594-A OIL DRILLING EQUIPMENT PHILLIPS PETROLEUM COMPANY (US) 1987-03-17 US disclosed
EP-0176991-A1 Composition and method for corrosion inhibition PHILLIPS PETROLEUM COMPANY (US) 1986-04-09 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-20080045729-A1 High-Purity Cycloaliphatic Diepoxy Compound and Preparation Process Thereof DUOX2, SQLE, HPD LMNA 4735/4885TSHR 1557/4885CHRM2 300/4885

“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.