SCHEMBL21157965

SCHEMBL21157965

CC(C)[C@H](C)C(=O)N[C@@H](CCCNC(N)=O)C(=O)Nc1ccc(CO)cc1

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ FURIN P09958 2/20 0.38
▸ SIRT1 Q96EB6 6/20 0.38
▸ HTT P42858 1/20 0.38
▸ NPY4R P50391 4/20 0.37
▸ NPY1R P25929 3/20 0.37
▸ NPY2R P49146 3/20 0.37
▸ NPY5R Q15761 3/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ SPHK1 Q9NYA1 1/20 0.37
▸ SIRT2 Q8IXJ6 6/20 0.37
▸ SIRT3 Q9NTG7 3/20 0.37
▸ SIRT5 Q9NXA8 1/20 0.37

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
SCHEMBL20806109 0.91 FURIN (0.45) FURINSIRT1HTTSMN1; SMN2SIRT2
SCHEMBL24611248 0.91 FURIN (0.45) FURINSIRT1HTTSMN1; SMN2SIRT2
SCHEMBL20739105 0.90 NPY4R (0.38) FURINSIRT1HTTNPY4RNPY1R
SCHEMBL12944390 0.90 NPY4R (0.38) FURINSIRT1HTTNPY4RNPY1R
SCHEMBL20158427 0.90 NPY4R (0.38) FURINSIRT1HTTNPY4RNPY1R
SCHEMBL15692085 0.90 NPY4R (0.38) FURINSIRT1HTTNPY4RNPY1R
SCHEMBL22315797 0.90 NPY4R (0.38) FURINSIRT1HTTNPY4RNPY1R
SCHEMBL84332 0.90 NPY4R (0.38) FURINSIRT1HTTNPY4RNPY1R
SCHEMBL7607468 0.90 NPY4R (0.38) FURINSIRT1HTTNPY4RNPY1R
SCHEMBL12634420 0.90 TAAR1 (0.41) SIRT1NPY4RNPY1RNPY2RNPY5R

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230141981-A1 NOVEL COMPOUNDS AND COMPOSITION FOR TARGETED THERAPY OF KIDNEY-ASSOCIATED CANCERS Shanghai MICURX Pharmaceuticals Co., Ltd. (CN) 2023-05-11 — — US disclosed
WO-2023280227-A2 LINKERS, DRUG LINKERS AND CONJUGATES THEREOF AND METHODS OF USING THE SAME PROFOUNDBIO US CO. (US) 2023-01-12 — — WO disclosed
US-20190209704-A1 NOVEL ANTIBODY-DRUG CONJUGATES AND RELATED COMPOUNDS, COMPOSITIONS AND METHODS OF USE SENSEI BIOTHERAPEUTICS, INC. 2019-07-11 — — 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 (2 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-20190209704-A1 NOVEL ANTIBODY-DRUG CONJUGATES AND RELATED COMPOUNDS, COMPOSITIONS AND METHODS OF USE CYTH3, CD47, FCGRT FURIN 147/4885SIRT1 3764/4885HTT 1812/4885
US-20230141981-A1 NOVEL COMPOUNDS AND COMPOSITION FOR TARGETED THERAPY OF KIDNEY-ASSOCIATED CANCERS GLS, ATP6V1B1, KRAS FURIN 1847/4885SIRT1 3292/4885HTT 4280/4885

“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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