SCHEMBL25879290

SCHEMBL25879290

C[C@H]1C[C@H](C(=O)OCC2CCOC2)CCO1

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
AOC3 Q16853 1/20 0.33
TP53 P04637 1/20 0.33
CYP3A4 P08684 1/20 0.33
HDAC3 O15379 1/20 0.31
HDAC1 Q13547 1/20 0.31
HDAC2 Q92769 1/20 0.31
GRM4 Q14833 1/20 0.31

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
SCHEMBL18461033 0.88 GRM4 (0.34) TP53CYP3A4GRM4
SCHEMBL18403207 0.78 PPM1B (0.32)
SCHEMBL18913786 0.78 GRM4 (0.34) TP53CYP3A4GRM4
SCHEMBL16882718 0.77 PPM1B (0.31)
SCHEMBL21581069 0.77 ALDH1A1 (0.30)
SCHEMBL25127023 0.76 TP53 (0.33) TP53CYP3A4
SCHEMBL21508993 0.76 EPHX2 (0.34)
SCHEMBL23959837 0.76 AOC3 (0.34) AOC3TP53CYP3A4HDAC3HDAC1
SCHEMBL12456296 0.76 GRM4 (0.33) GRM4
SCHEMBL23811147 0.75 PPM1B (0.42)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230212133-A1 Safe, Environmentally Friendly and Controllable Method for Preparing Cycloaliphatic Diepoxides JIANGSU TETRA NEW MATERIAL TECHNOLOGY CO., LTD. (CN) 2023-07-06 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-20230212133-A1 Safe, Environmentally Friendly and Controllable Method for Preparing Cycloaliphatic Diepoxides DDT, EPHX2, HSD11B2 AOC3 125/4885TP53 4187/4885CYP3A4 609/4885

“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.