SCHEMBL21472067

SCHEMBL21472067

CC(C)(C)OC1CC(Oc2ccc(CN)nc2)C1

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MBOAT4 Q96T53 1/20 0.36
GRIN1 Q05586 5/20 0.33
GRIN2B Q13224 5/20 0.33
LNPEP Q9UIQ6 3/20 0.32
AOC3 Q16853 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
SCHEMBL21421874 0.82 GRIN1 (0.32) MBOAT4GRIN1GRIN2BLNPEP
SCHEMBL20128770 0.81 GRIN1 (0.31) MBOAT4GRIN1GRIN2B
SCHEMBL21673606 0.79 MBOAT4 (0.34) MBOAT4GRIN1GRIN2BLNPEP
SCHEMBL24654249 0.77 ACACB (0.33)
SCHEMBL20128806 0.75
SCHEMBL2586308 0.75 LOX (0.47) MBOAT4GRIN1GRIN2BLNPEP
SCHEMBL2581578 0.75 LOX (0.47) MBOAT4GRIN1GRIN2BLNPEP
SCHEMBL20128807 0.75 HRH3 (0.37) GRIN1GRIN2B
SCHEMBL20128779 0.74 GRIN1 (0.32) GRIN1GRIN2B
SCHEMBL21673536 0.74 LNPEP (0.30) LNPEP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11161841-B2 Modulators of proteolysis and associated methods of use ARVINAS OPERATIONS, INC. (US) 2021-11-02 US disclosed
US-20190315732-A1 MODULATORS OF PROTEOLYSIS AND ASSOCIATED METHODS OF USE ARVINAS OPERATIONS, INC. 2019-10-17 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 (2 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-20190315732-A1 MODULATORS OF PROTEOLYSIS AND ASSOCIATED METHODS OF USE MDM2, CRBN, VHL MBOAT4 4299/4885GRIN1 2783/4885GRIN2B 3367/4885
US-11161841-B2 Modulators of proteolysis and associated methods of use MDM2, CRBN, VHL MBOAT4 4299/4885GRIN1 2783/4885GRIN2B 3367/4885

“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.