SCHEMBL20206316

SCHEMBL20206316

CC(C)OCCCCCOCCCOCC(C)(C)C

nearest known ligand 0.36

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GBA2 Q9HCG7 2/20 0.36
CES1 P23141 1/20 0.32
EPHX2 P34913 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
SCHEMBL23377863 0.98 GBA2 (0.33) GBA2
SCHEMBL20206407 0.94 GBA2 (0.33) GBA2EPHX2
SCHEMBL19426716 0.92 EPHX2 (0.37) GBA2CES1EPHX2
SCHEMBL21162382 0.90 EPHX2 (0.35) GBA2EPHX2
SCHEMBL19426794 0.83
SCHEMBL21162433 0.83
SCHEMBL23921497 0.83
SCHEMBL20206315 0.83
SCHEMBL4759654 0.81
SCHEMBL26739892 0.80 ALDH1A1 (0.38) EPHX2

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-20210145832-A1 TANK-BINDING KINASE-1 PROTACs AND ASSOCIATED METHODS OF USE ARVINAS OPERATIONS, INC. 2021-05-20 US disclosed
US-20180147202-A1 TANK-BINDING KINASE-1 PROTACs AND ASSOCIATED METHODS OF USE Arvinas, Inc. (US) 2018-05-31 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-20180147202-A1 TANK-BINDING KINASE-1 PROTACs AND ASSOCIATED METHODS OF USE TBK1, TBKBP1, TNKS GBA2 3916/4885CES1 2763/4885EPHX2 3642/4885
US-20210145832-A1 TANK-BINDING KINASE-1 PROTACs AND ASSOCIATED METHODS OF USE TBK1, TNKS, TBKBP1 GBA2 3759/4885CES1 2557/4885EPHX2 3475/4885

“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.