SCHEMBL21058443

SCHEMBL21058443

CC(C)(C)OC(=O)n1cc(B2OC(C)(C)C(C)(C)O2)c2cc(F)cc(Cl)c21

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ AAK1 Q2M2I8 1/20 0.35
▸ USP30 Q70CQ3 2/20 0.33
▸ BACE1 P56817 1/20 0.32
▸ BACE2 Q9Y5Z0 1/20 0.32
▸ PRMT5 O14744 1/20 0.32
▸ WDR77 Q9BQA1 1/20 0.32
▸ LIPE Q05469 1/20 0.31
▸ NR3C2 P08235 1/20 0.30

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
SCHEMBL25174282 0.89 BACE1 (0.33) USP30BACE1BACE2PRMT5WDR77
SCHEMBL30369811 0.89 BACE1 (0.33) USP30BACE1BACE2PRMT5WDR77
SCHEMBL17518584 0.85 BACE1 (0.34) AAK1USP30BACE1BACE2PRMT5
SCHEMBL29363705 0.85 GPR119 (0.33) —
SCHEMBL25028818 0.85 GPR119 (0.33) —
SCHEMBL19876637 0.84 PTGDR2 (0.31) —
SCHEMBL12005659 0.83 USP30 (0.35) AAK1USP30PRMT5WDR77
SCHEMBL28594656 0.81 HTR6 (0.40) USP30BACE1BACE2PRMT5WDR77
SCHEMBL18270928 0.80 USP30 (0.36) USP30BACE1BACE2PRMT5WDR77
SCHEMBL16205575 0.79 USP30 (0.33) AAK1USP30PRMT5WDR77

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-20190185456-A1 INHIBITORS OF INFLUENZA VIRUS REPLICATION, APPLICATION METHODS AND USES THEREOF SUNSHINE LAKE PHARMA CO., LTD. (CN) 2019-06-20 — — 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-20190185456-A1 INHIBITORS OF INFLUENZA VIRUS REPLICATION, APPLICATION METHODS AND USES THEREOF POLRMT, EIF2AK2, POLM AAK1 2208/4885USP30 1402/4885BACE1 2968/4885

“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.

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