SCHEMBL9359175

SCHEMBL9359175

O=C(NC(Cc1ccc(O)c([N+](=O)[O-])c1)C(=O)O)OCC1c2ccccc2-c2ccccc21

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ ALB P02768 1/20 0.48
▸ IL2 P60568 1/20 0.48
▸ PTPN1 P18031 3/20 0.48
▸ MDM4 O15151 3/20 0.47
▸ TP53 P04637 3/20 0.47
▸ SLC17A5 Q9NRA2 1/20 0.44
▸ MDM2 Q00987 2/20 0.44
▸ CASP3 P42574 2/20 0.43
▸ ALDH1A1 P00352 1/20 0.42
▸ EPHX2 P34913 1/20 0.42
▸ GRB2 P62993 1/20 0.41

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
SCHEMBL29400507 1.00 ALB (0.48) ALBIL2PTPN1MDM4TP53
SCHEMBL5062433 1.00 ALB (0.48) ALBIL2PTPN1MDM4TP53
SCHEMBL8697104 0.90 MDM4 (0.48) PTPN1MDM4TP53SLC17A5MDM2
SCHEMBL14060727 0.88 PTPN1 (0.43) ALBIL2PTPN1MDM4TP53
SCHEMBL15762708 0.88 PTPN1 (0.43) ALBIL2PTPN1MDM4TP53
SCHEMBL9732381 0.87 PTPN1 (0.54) PTPN1MDM4TP53SLC17A5MDM2
SCHEMBL29500417 0.87 PTPN1 (0.54) PTPN1MDM4TP53SLC17A5MDM2
SCHEMBL29843110 0.87 PTPN1 (0.54) PTPN1MDM4TP53SLC17A5MDM2
SCHEMBL3868341 0.87 PTPN1 (0.46) ALBIL2PTPN1MDM4TP53
Catechol SCHEMBL18074826 0.86 PTPN1 (0.53) PTPN1MDM4TP53SLC17A5MDM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4698551-A1 NOVEL SMALL MOLECULE AGONISTS OF INSULIN RECEPTOR (INSR) AS ANTI-DIABETES DRUGS The University of Hong Kong (CN) 2026-02-25 — — EP disclosed
US-20260036595-A1 STRUCTURE-BASED PEPTIDES FOR DETECTION OF TRANSTHYRETIN AMYLOID FIBRILS AND AGGREGATES IN PREECLAMPSIA THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2026-02-05 — — US disclosed
US-20250362310-A1 STRUCTURE-BASED PROBE FOR DETECTION OF TRANSTHYRETIN AMYLOID FIBRILS AND AGGREGATES THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2025-11-27 — — US disclosed
CN-119119182-A Novel SS-31 derivative, and preparation method and application thereof 青岛山大齐鲁医院(山东大学齐鲁医院(青岛)) 2024-12-13 — — CN disclosed
WO-2024217497-A1 NOVEL SMALL MOLECULE AGONISTS OF INSULIN RECEPTOR (INSR) AS ANTI-DIABETES DRUGS THE UNIVERSITY OF HONG KONG (CN) 2024-10-24 — — WO disclosed
CN-116650617-A Structure-based peptide inhibitors of alpha-synuclein aggregation 加利福尼亚大学董事会 2023-08-29 — — CN disclosed
US-11390646-B2 Structure-based peptide inhibitors of α-synuclein aggregation THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2022-07-19 — — US disclosed
EP-2994476-B1 STRUCTURE-BASED PEPTIDE INHIBITORS OF P53 AGGREGATION AS A NEW APPROACH TO CANCER THERAPEUTICS UNIV CALIFORNIA (US) 2019-07-31 — — EP disclosed
EP-0528854-B1 FLUOROGENIC PEPTIDES AND THEIR USE IN THE DETERMINATION OF ENZYMATIC ACTIVITIES CARLSBERG AS (DK) 1994-12-28 — — EP disclosed
EP-0528854-A1 FLUOROGENIC PEPTIDES AND THEIR USE IN THE DETERMINATION OF ENZYMATIC ACTIVITIES. CARLSBERG AS (DK) 1993-03-03 — — EP disclosed
WO-1991016336-A1 FLUOROGENIC PEPTIDES AND THEIR USE IN THE DETERMINATION OF ENZYMATIC ACTIVITIES CARLSBERG A/S (DK) 1991-10-31 — — WO 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-11390646-B2 Structure-based peptide inhibitors of α-synuclein aggregation SNCA, PARK7, IAPP ALB 1267/4885IL2 2911/4885PTPN1 2024/4885
US-20260036595-A1 STRUCTURE-BASED PEPTIDES FOR DETECTION OF TRANSTHYRETIN AMYLOID FIBRILS AND AGGREGATES IN PREECLAMPSIA TTR, APP, SERPINA3 ALB 76/4885IL2 4149/4885PTPN1 2453/4885

“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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