SCHEMBL25518970

SCHEMBL25518970

CC(C)O[C@@H]1[C@H]2OC(C)(C)O[C@H]2[C@@H](O[Si](c2ccccc2)(c2ccccc2)C(C)(C)C)[C@@H]2OC(C)(C)O[C@@H]12

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SMYD2 Q9NRG4 2/20 0.34
CYP3A4 P08684 2/20 0.32
MAPK1 P28482 1/20 0.32
HTT P42858 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
BACE1 P56817 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
SCHEMBL23635234 0.86 SMYD2 (0.31) SMYD2
SCHEMBL25518968 0.84 CYP3A4 (0.36) CYP3A4MAPK1BACE1
SCHEMBL10322922 0.79 BACE1 (0.32) SMYD2CYP3A4MAPK1BACE1
SCHEMBL12509355 0.79 BACE1 (0.32) SMYD2CYP3A4MAPK1BACE1
SCHEMBL15935851 0.79 BACE1 (0.32) SMYD2CYP3A4MAPK1BACE1
SCHEMBL24673063 0.73 SMYD2 (0.32) SMYD2CYP3A4MAPK1HTTSMN1; SMN2
SCHEMBL12573485 0.71 CYP3A4 (0.32) CYP3A4MAPK1
SCHEMBL12269674 0.70 SMYD2 (0.32) SMYD2CYP3A4HTTSMN1; SMN2
SCHEMBL1139972 0.70 BACE1 (0.36) SMYD2CYP3A4MAPK1HTTSMN1; SMN2
SCHEMBL12269801 0.69 SMYD2 (0.31) SMYD2CYP3A4HTTSMN1; SMN2BACE1

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-11649475-B2 Dioxetane compounds and their use for the detection of microorganisms RAMOT AT TEL-AVIV UNIVERSITY LTD. (IL) 2023-05-16 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-11649475-B2 Dioxetane compounds and their use for the detection of microorganisms DAXX, LITAF, EDF1 SMYD2 3812/4885CYP3A4 140/4885MAPK1 1343/4885

“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.