SCHEMBL20206643

SCHEMBL20206643

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

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ FURIN P09958 5/20 0.42
▸ HTT P42858 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ SPHK1 Q9NYA1 1/20 0.39
▸ POLB P06746 2/20 0.37
▸ LMNA P02545 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ SIRT1 Q96EB6 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ NPY4R P50391 3/20 0.35
▸ NPY1R P25929 2/20 0.35
▸ NPY2R P49146 2/20 0.35
▸ NPY5R Q15761 2/20 0.35
▸ REN P00797 1/20 0.35

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
SCHEMBL14234316 1.00 FURIN (0.42) FURINHTTSMN1; SMN2SPHK1POLB
SCHEMBL24728301 1.00 FURIN (0.42) FURINHTTSMN1; SMN2SPHK1POLB
SCHEMBL21965275 0.97 FURIN (0.41) FURINHTTSMN1; SMN2SPHK1SIRT1
SCHEMBL27291528 0.92 FURIN (0.49) FURINHTTSMN1; SMN2SPHK1POLB
SCHEMBL17133811 0.91 FURIN (0.45) FURINHTTSMN1; SMN2POLBLMNA
SCHEMBL21122921 0.91 FURIN (0.41) FURINHTTSMN1; SMN2POLBLMNA
SCHEMBL17133812 0.91 FURIN (0.45) FURINHTTSMN1; SMN2POLBLMNA
SCHEMBL24414345 0.91 FURIN (0.41) FURINHTTSMN1; SMN2SPHK1POLB
SCHEMBL16847753 0.91 FURIN (0.43) FURINHTTSMN1; SMN2POLBLMNA
SCHEMBL23386894 0.90 SPHK1 (0.45) FURINHTTSPHK1POLBLMNA

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
WO-2023061457-A1 ANTIBODY-DRUG CONJUGATE AND APPLICATION THEREOF 百奥泰生物制药股份有限公司 2023-04-20 — — WO disclosed
WO-2022253284-A1 DRUG CONJUGATE AND USE THEREOF 百奥泰生物制药股份有限公司 2022-12-08 — — WO disclosed
US-20180147291-A1 PRODRUGS OF PEPTIDE EPOXY KETONE PROTEASE INHIBITORS ONYX THERAPEUTICS, INC. 2018-05-31 — — 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-20180147291-A1 PRODRUGS OF PEPTIDE EPOXY KETONE PROTEASE INHIBITORS PREP, VIP, PEPD FURIN 7/4885HTT 4454/4885SMN1; SMN2 4444/4885

“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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