SCHEMBL20201542

SCHEMBL20201542

CC(C)(C)COCCCCOC(C)(C)C

nearest known ligand 0.37

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GBA2 Q9HCG7 2/20 0.37
CES1 P23141 1/20 0.32
CYP4F2 P78329 1/20 0.32
CYP4A11 Q02928 1/20 0.32

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
SCHEMBL24667814 0.98 GBA2 (0.39) GBA2CES1CYP4F2CYP4A11
SCHEMBL20201547 0.95 GBA2 (0.35) GBA2CES1CYP4F2CYP4A11
SCHEMBL20201545 0.95 GBA2 (0.35) GBA2CES1CYP4F2CYP4A11
SCHEMBL19420786 0.95 GBA2 (0.38) GBA2CES1CYP4F2CYP4A11
SCHEMBL20314553 0.95 GBA2 (0.33) GBA2
SCHEMBL19420784 0.93 GBA2 (0.37) GBA2CES1CYP4F2CYP4A11
SCHEMBL19420766 0.93 GBA2 (0.37) GBA2CES1CYP4F2CYP4A11
SCHEMBL20314554 0.93 GBA2 (0.33) GBA2CYP4F2CYP4A11
SCHEMBL18591714 0.93 GBA2 (0.33) GBA2CYP4F2CYP4A11
SCHEMBL20314558 0.93 GBA2 (0.33) GBA2CYP4F2CYP4A11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230357180-A1 DEGRADERS AND DEGRONS FOR TARGETED PROTEIN DEGRADATION C4 THERAPEUTICS, INC. (US) 2023-11-09 US disclosed
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 (3 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 2763/4885CYP4F2 4782/4885
US-20210145832-A1 TANK-BINDING KINASE-1 PROTACs AND ASSOCIATED METHODS OF USE TBK1, TNKS, TBKBP1 GBA2 3759/4885CES1 2557/4885CYP4F2 4806/4885
US-20230357180-A1 DEGRADERS AND DEGRONS FOR TARGETED PROTEIN DEGRADATION STUB1, MDM2, USP30 GBA2 1999/4885CES1 3204/4885CYP4F2 4201/4885

“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.