SCHEMBL9822708

SCHEMBL9822708

C[C@H](N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)O

nearest known ligand 0.65

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ ACE P12821 2/20 0.65
▸ ECE1 P42892 12/20 0.61
▸ KDM4E B2RXH2 1/20 0.60
▸ APAF1 O14727 1/20 0.60
▸ POLB P06746 1/20 0.60
▸ MAPT P10636 1/20 0.60
▸ RECQL P46063 1/20 0.60
▸ L3MBTL1 Q9Y468 1/20 0.60
▸ GHSR Q92847 1/20 0.60
▸ MMP9 P14780 1/20 0.59
▸ MMP8 P22894 1/20 0.59
▸ ERAP2 Q6P179 1/20 0.58

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
SCHEMBL30051844 1.00 ACE (0.65) ACEECE1KDM4EAPAF1POLB
SCHEMBL29749345 0.98 ACE (0.63) ACEECE1KDM4EAPAF1POLB
SCHEMBL30051087 0.93 ACE (0.75) ACEECE1ERAP2
SCHEMBL30051359 0.92 ACE (0.64) ACEECE1KDM4EAPAF1POLB
SCHEMBL30053239 0.91 CTSC (0.66) ACEECE1KDM4EAPAF1POLB
SCHEMBL3497589 0.91 ACE (0.72) ACEECE1
SCHEMBL30051627 0.91 ACE (0.72) ACEECE1
SCHEMBL1228369 0.91 ACE (0.78) ACEECE1
SCHEMBL2488765 0.91 ACE (0.78) ACEECE1
SCHEMBL9235801 0.91 ACE (0.78) ACEECE1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230107647-A1 SINGLE MOLECULE PEPTIDE SEQUENCING BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2023-04-06 — — US disclosed
US-11162952-B2 Single molecule peptide sequencing BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2021-11-02 — — US disclosed
US-20210072251-A9 SINGLE MOLECULE PEPTIDE SEQUENCING BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM 2021-03-11 — — US disclosed
US-20200124613-A1 SINGLE MOLECULE PEPTIDE SEQUENCING UNIV TEXAS (US) 2020-04-23 — — US disclosed
US-10545153-B2 Single molecule peptide sequencing BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2020-01-28 — — US disclosed
US-5036052-A Containing a dipeptide of tryptophan and alanine or lecine and no stabilizer; discoloration inhibition MORISHITA PHARMACEUTICAL CO., LTD. (JP) 1991-07-30 — — US disclosed
EP-0347890-A1 Amino acid nutrient compositions Roussel Morishita Co., Ltd. (JP) 1989-12-27 — — EP 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 (4 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-20230107647-A1 SINGLE MOLECULE PEPTIDE SEQUENCING QPCTL, ANPEP, VIP ACE 1689/4885ECE1 1401/4885KDM4E 455/4885
US-11162952-B2 Single molecule peptide sequencing MICA, ANPEP, VIP ACE 2420/4885ECE1 2628/4885KDM4E 4067/4885
US-20210072251-A9 SINGLE MOLECULE PEPTIDE SEQUENCING QPCTL, VIP, ANPEP ACE 1809/4885ECE1 1123/4885KDM4E 751/4885
US-20200124613-A1 SINGLE MOLECULE PEPTIDE SEQUENCING QPCTL, VIP, ANPEP ACE 1809/4885ECE1 1123/4885KDM4E 751/4885

“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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