SCHEMBL35210564

SCHEMBL35210564

Cc1nn(C)c(NC(=O)OC(C)(C)C)c1B1OC(C)(C)C(C)(C)O1

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
AAK1 Q2M2I8 2/20 0.35
PRMT5 O14744 1/20 0.35
WDR77 Q9BQA1 1/20 0.35
LPAR1 Q92633 1/20 0.34
USP30 Q70CQ3 2/20 0.33
PTGDR2 Q9Y5Y4 1/20 0.32
MAPK14 Q16539 1/20 0.32
LCK P06239 4/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
BRD9 Q9H8M2 1/20 0.30
CYP17A1 P05093 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
SCHEMBL26970589 0.86 USP30 (0.34) AAK1PRMT5WDR77LPAR1USP30
SCHEMBL31206495 0.76 AAK1 (0.35) AAK1PRMT5WDR77USP30
SCHEMBL29341854 0.76 GSK3B (0.38) AAK1PRMT5WDR77LPAR1USP30
SCHEMBL15591807 0.73 PTGDR2 (0.36) LPAR1PTGDR2MAPK14LCKCA1
SCHEMBL30863598 0.73 MEN1 (0.46) LPAR1PTGDR2MAPK14LCKCA1
SCHEMBL24049966 0.72 AAK1 (0.36) AAK1PRMT5WDR77USP30CA1
SCHEMBL20518894 0.72 AAK1 (0.41) AAK1PRMT5WDR77USP30BRD9
SCHEMBL111352 0.72 USP30 (0.35) AAK1PRMT5WDR77USP30
SCHEMBL32670723 0.72 LCK (0.46) USP30LCKCA1CA2
SCHEMBL22858337 0.71 USP30 (0.33) AAK1PRMT5WDR77USP30MAPK14

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-20260125389-A1 MEMBRANE-ASSOCIATED TYROSINE AND THREONINE KINASE INHIBITOR AND USE THEREOF HAINAN SIMCERE ZAIMING PHARMACEUTICAL CO LTD (CN) 2026-05-07 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-20260125389-A1 MEMBRANE-ASSOCIATED TYROSINE AND THREONINE KINASE INHIBITOR AND USE THEREOF PKMYT1, PKN1, ROS1 AAK1 2016/4885PRMT5 306/4885WDR77 2396/4885

“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.