SCHEMBL24944308

SCHEMBL24944308

CC(C)(C)OC(=O)n1c(C(=O)O)cc2ccc(B3OC(C)(C)C(C)(C)O3)cc21

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 1/20 0.39
PRMT5 O14744 1/20 0.39
WDR77 Q9BQA1 1/20 0.39
AAK1 Q2M2I8 2/20 0.38
BACE1 P56817 1/20 0.36
BACE2 Q9Y5Z0 1/20 0.36
IRAK4 Q9NWZ3 1/20 0.36
AURKA O14965 1/20 0.35
CDK2 P24941 1/20 0.35
F2 P00734 1/20 0.34
F11 P03951 1/20 0.34
PRSS1 P07477 1/20 0.34
PRSS2 P07478 1/20 0.34
PRSS3 P35030 1/20 0.34
NR1H2 P55055 6/20 0.34
NR1H3 Q13133 1/20 0.34
HIF1A Q16665 1/20 0.34
LIPG Q9Y5X9 2/20 0.34
LPL P06858 1/20 0.34
DGAT1 O75907 1/20 0.34

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
SCHEMBL1565096 0.91 USP30 (0.39) USP30PRMT5WDR77AAK1BACE1
SCHEMBL29504435 0.89 USP30 (0.40) USP30PRMT5WDR77AAK1BACE1
SCHEMBL3451480 0.89 USP30 (0.40) USP30PRMT5WDR77AAK1BACE1
SCHEMBL13144338 0.86 NOD2 (0.39) USP30PRMT5WDR77AAK1BACE1
SCHEMBL3642532 0.85 IRAK4 (0.40) IRAK4F2F11PRSS1PRSS2
SCHEMBL31282179 0.84 NR1H2 (0.50) NR1H2NR1H3
SCHEMBL3076889 0.83 PRMT5 (0.38) USP30PRMT5WDR77AAK1BACE1
SCHEMBL13348212 0.81 USP30 (0.40) USP30PRMT5WDR77AAK1BACE1
SCHEMBL12172282 0.79 PRMT5 (0.43) USP30PRMT5WDR77AAK1BACE1
SCHEMBL20618017 0.78 MCL1 (0.50) IRAK4F2F11PRSS1PRSS2

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-20230030115-A1 RHO-ASSOCIATED PROTEIN KINASE INHIBITOR, PHARMACEUTICAL COMPOSITION COMPRISING SAME, AND PREPARATION METHOD AND USE THEREOF BEIJING TIDE PHARMACEUTICAL CO LTD (CN) 2023-02-02 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-20230030115-A1 RHO-ASSOCIATED PROTEIN KINASE INHIBITOR, PHARMACEUTICAL COMPOSITION COMPRISING SAME, AND PREPARATION METHOD AND USE THEREOF ROCK1, ROCK2, RHOA USP30 1754/4885PRMT5 420/4885WDR77 1142/4885

“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.