SCHEMBL6745244

SCHEMBL6745244

CC(C)(O)C(C)(C)O.C[Si](C)(C)C

nearest known ligand 0.43

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.43
ALDH1A1 P00352 2/20 0.33
TSHR P16473 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
SCHEMBL6225188 0.88 THRB (0.35) THRB
SCHEMBL27028519 0.84 THRB (0.55) THRBALDH1A1TSHR
SCHEMBL504018 0.84 THRB (0.55) THRBALDH1A1TSHR
SCHEMBL8968 0.84
Water SCHEMBL3827178 0.78 THRB (0.50) THRBALDH1A1TSHR
SCHEMBL3230777 0.78 THRB (0.50) THRBALDH1A1TSHR
Hydrochloric Acid SCHEMBL7537660 0.78
SCHEMBL21494164 0.78 THRB (0.50) THRBALDH1A1TSHR
SCHEMBL129302 0.78
Ammonia Solution, Strong SCHEMBL8694521 0.78

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-20040209897-A1 Mitogen activated protein kinase-activated protein kinase-2 inhibiting compounds PHARMACIA CORPORATION 2004-10-21 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-20040209897-A1 Mitogen activated protein kinase-activated protein kinase-2 inhibiting compounds MAPKAPK2, MAP3K2, MKNK2 THRB 2220/4885ALDH1A1 4638/4885TSHR 3883/4885

“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.