SCHEMBL3448562

SCHEMBL3448562

CC(C)(C)OC(=O)C1CC1c1cncc(B2OC(C)(C)C(C)(C)O2)c1

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 2/20 0.37
PRMT5 O14744 1/20 0.35
WDR77 Q9BQA1 1/20 0.35
BACE1 P56817 1/20 0.35
BACE2 Q9Y5Z0 1/20 0.35
DGAT1 O75907 1/20 0.34
AAK1 Q2M2I8 2/20 0.33
FFAR1 O14842 1/20 0.32
MAPK1 P28482 1/20 0.32
CYP17A1 P05093 1/20 0.30
CYP19A1 P11511 1/20 0.30
GSK3A P49840 1/20 0.30
GSK3B P49841 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
SCHEMBL13310393 1.00 USP30 (0.37) USP30PRMT5WDR77BACE1BACE2
SCHEMBL3448559 1.00 USP30 (0.37) USP30PRMT5WDR77BACE1BACE2
SCHEMBL3452373 0.83 PRMT5 (0.37) USP30PRMT5WDR77BACE1BACE2
SCHEMBL3452376 0.83 PRMT5 (0.37) USP30PRMT5WDR77BACE1BACE2
SCHEMBL13310395 0.83 PRMT5 (0.37) USP30PRMT5WDR77BACE1BACE2
SCHEMBL10138694 0.78 USP30 (0.40) USP30PRMT5WDR77BACE1BACE2
SCHEMBL25087107 0.77 USP30 (0.48) USP30PRMT5WDR77BACE1BACE2
SCHEMBL13310391 0.76 RAB9A (0.39) USP30MAPK1
SCHEMBL3348396 0.76 RAB9A (0.39) USP30MAPK1
SCHEMBL27190474 0.76 ADORA2A (0.34) MAPK1

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-20100137313-A1 HETEROCYCLIC DERIVATIVES AND METHODS OF USE THEREOF ASTRAZENECA AB 2010-06-03 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-20100137313-A1 HETEROCYCLIC DERIVATIVES AND METHODS OF USE THEREOF SDHA, SDHB, UROD USP30 3679/4885PRMT5 3689/4885WDR77 4376/4885

“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.