SCHEMBL24312045

SCHEMBL24312045

CNC(=O)c1cccc2c1CCN(C(=O)OCC(C)C)C2

nearest known ligand 0.45

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAP3K5 Q99683 3/20 0.45
PRMT5 O14744 5/20 0.44
WDR77 Q9BQA1 5/20 0.44
CARM1 Q86X55 2/20 0.43
ABHD6 Q9BV23 5/20 0.42
ACACB O00763 1/20 0.40
PTGDR2 Q9Y5Y4 2/20 0.40
HRH1 P35367 1/20 0.39
SLC6A15 Q9H2J7 1/20 0.39

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
SCHEMBL24312147 0.87 PRMT5 (0.46) MAP3K5PRMT5WDR77ABHD6PTGDR2
SCHEMBL15355424 0.78 PRMT5 (0.67) PRMT5WDR77ABHD6
SCHEMBL14868188 0.71 ESR2 (0.50) MAP3K5PRMT5WDR77ABHD6
SCHEMBL1201971 0.68 PRMT5 (0.48) MAP3K5PRMT5WDR77ABHD6PTGDR2
SCHEMBL10197664 0.68 CARM1 (0.53) MAP3K5CARM1ABHD6
SCHEMBL28486528 0.68 RAB9A (0.44) MAP3K5PRMT5WDR77PTGDR2HRH1
SCHEMBL15504678 0.67 ALDH1A1 (0.43) CARM1ABHD6
SCHEMBL1857142 0.67 UCHL1 (0.53) ABHD6
SCHEMBL30647075 0.67 UCHL1 (0.53) ABHD6
SCHEMBL30404761 0.67 TMEM97 (0.47) MAP3K5PRMT5WDR77ABHD6ACACB

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-20220105194-A1 CONJUGATE COMPRISING LIGAND, SPACER, PEPTIDE LINKER, AND BIOMOLECULE ASTELLAS PHARMA INC. (JP) 2022-04-07 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-20220105194-A1 CONJUGATE COMPRISING LIGAND, SPACER, PEPTIDE LINKER, AND BIOMOLECULE MUC1, CA14, CA13 MAP3K5 4519/4885PRMT5 2013/4885WDR77 1997/4885

“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.