SCHEMBL23664656

SCHEMBL23664656

CCC(C)(C)OC(=O)COCCOCCOCCO

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
THRB P10828 1/20 0.37
HTT P42858 1/20 0.37
MAPT P10636 1/20 0.37
TSHR P16473 2/20 0.36
MAPK1 P28482 1/20 0.36
ALDH1A1 P00352 1/20 0.35
CYP4F2 P78329 1/20 0.35
CYP4A11 Q02928 1/20 0.35

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
SCHEMBL21106744 0.87 APLNR (0.30)
SCHEMBL12967160 0.86 ALDH1A1 (0.32) TSHRALDH1A1
SCHEMBL20057022 0.86 EPHX2 (0.31)
SCHEMBL29334924 0.84 CYP4F2 (0.47) MEN1KMT2ATHRBHTTMAPT
SCHEMBL1401683 0.83 MEN1 (0.44) MEN1KMT2ATHRBHTTMAPT
SCHEMBL13799308 0.83 MEN1 (0.44) MEN1KMT2ATHRBHTTMAPT
SCHEMBL1401413 0.83 MEN1 (0.44) MEN1KMT2ATHRBHTTMAPT
SCHEMBL30244596 0.83 MEN1 (0.44) MEN1KMT2ATHRBHTTMAPT
SCHEMBL4508237 0.83 MEN1 (0.44) MEN1KMT2ATHRBHTTMAPT
SCHEMBL17822966 0.83 MEN1 (0.44) MEN1KMT2ATHRBHTTMAPT

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-20210220475-A1 EGFR PROTEOLYSIS TARGETING CHIMERIC MOLECULES AND ASSOCIATED METHODS OF USE NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2021-07-22 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-20210220475-A1 EGFR PROTEOLYSIS TARGETING CHIMERIC MOLECULES AND ASSOCIATED METHODS OF USE TBK1, EGFR, CBL MEN1 3927/4885KMT2A 2593/4885THRB 1970/4885

“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.