SCHEMBL1133288

SCHEMBL1133288

COC(=O)[C@H](Cc1ccc(I)cc1)NC(=O)OC(C)(C)C

nearest known ligand 0.57

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KLK5 Q9Y337 1/20 0.57
CTSS P25774 7/20 0.52
CTSK P43235 6/20 0.52
CTSB P07858 2/20 0.51
CTSL P07711 1/20 0.51
ITGB3 P05106 1/20 0.49
ITGA2B P08514 1/20 0.49
ACE P12821 1/20 0.49
EPHX2 P34913 1/20 0.45
ITGA4 P13612 1/20 0.45
ITGB7 P26010 1/20 0.45
HDAC8 Q9BY41 1/20 0.45
ATM Q13315 1/20 0.45
AKT1 P31749 1/20 0.45
PPARA Q07869 2/20 0.44
PPARG P37231 1/20 0.44
MDM4 O15151 1/20 0.44
MDM2 Q00987 1/20 0.44

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
SCHEMBL31571430 1.00 KLK5 (0.57) KLK5CTSSCTSKCTSBCTSL
SCHEMBL1133286 1.00 KLK5 (0.57) KLK5CTSSCTSKCTSBCTSL
SCHEMBL5887534 0.93 CTSS (0.53) KLK5CTSSCTSKCTSBCTSL
SCHEMBL5887530 0.93 CTSS (0.53) KLK5CTSSCTSKCTSBCTSL
SCHEMBL1111226 0.90 CTSS (0.50) KLK5CTSSCTSKCTSBCTSL
SCHEMBL1111230 0.90 CTSS (0.50) KLK5CTSSCTSKCTSBCTSL
SCHEMBL5887200 0.88 CTSS (0.49) KLK5CTSSCTSKCTSBCTSL
SCHEMBL5887203 0.88 CTSS (0.49) KLK5CTSSCTSKCTSBCTSL
SCHEMBL12035376 0.88 KLK5 (0.58) KLK5CTSSCTSKCTSBCTSL
SCHEMBL16232664 0.88 KLK5 (0.58) KLK5CTSSCTSKCTSBCTSL

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 167 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-121758479-A L-4-boron-based phenylalanine and synthesis process and application thereof 北京新粒科技有限公司 2026-03-31 CN disclosed
US-12522592-B2 ERAP inhibitors UNIVERSITE DE LILLE (FR) 2026-01-13 US disclosed
EP-4263533-B1 ERAP INHIBITORS UNIV LILLE (FR) 2025-08-20 EP disclosed
WO-2025106386-A1 A CYCLIC PEPTIDE FOR TRAPPING INTERLEUKIN-1 BETA MERCK SHARP & DOHME LLC (US) 2025-05-22 WO disclosed
US-20250152658-A1 CYCLIC PEPTIDE FOR TRAPPING INTERLEUKIN-1 BETA MERCK SHARP & DOHME LLC (US) 2025-05-15 US disclosed
EP-4425181-A1 COMPOSITION FOR DETECTING OR MEASURING ANALYTE Bertis Inc (KR) 2024-09-04 EP disclosed
US-20240150933-A1 AMINO ACID DERIVATIVE-CONTAINING ORGANIC MOLECULES FOR IMPROVED OPTICAL PROPERTIES IN AR/VR COMPONENTS META PLATFORMS TECHNOLOGIES, LLC 2024-05-09 US disclosed
US-20240101542-A1 ERAP INHIBITORS INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (FR) 2024-03-28 US disclosed
US-20240011979-A1 COMPOSITION FOR DETECTING OR MEASURING ANALYTES BERTIS INC. (KR) 2024-01-11 US disclosed
WO-2023244554-A1 CYCLIC PEPTIDES FOR TRAPPING INTERLEUKIN-1 BETA MERCK SHARP & DOHME LLC (US) 2023-12-21 WO disclosed
WO-2000043372-A1 ACYL DERIVATIVES WHICH TREAT VLA-4 RELATED DISORDERS ELAN PHARMACEUTICALS, INC. (US) 2000-07-27 WO disclosed
CN-1255912-A Process for removal of heavy metals ZAMBON SPA (IT) 2000-06-07 CN disclosed
EP-0981507-A1 PROCESS FOR THE REMOVAL OF HEAVY METALS ZAMBON GROUP S.p.A. (IT) 2000-03-01 EP disclosed
EP-0970091-A1 PROCESS FOR THE PREPARATION OF HETEROARYL-ZINC HALIDES ZAMBON GROUP S.p.A. (IT) 2000-01-12 EP disclosed
EP-0948492-A1 PROCESS FOR THE PREPARATION OF HETEROARYL-PHENYLALANINES ZAMBON GROUP S.p.A. (IT) 1999-10-13 EP disclosed
WO-1999035163-A1 PHENYLALANINE DERIVATIVES CELLTECH THERAPEUTICS LIMITED (GB) 1999-07-15 WO disclosed
WO-1999029640-A2 COMPOSITIONS AND METHODS FOR MODULATING THE ACTIVITY OF FIBROBLAST GROWTH FACTOR EISAI CO., LTD. (JP) 1999-06-17 WO disclosed
WO-1998051646-A1 PROCESS FOR THE REMOVAL OF HEAVY METALS ZAMBON GROUP S.P.A. (IT) 1998-11-19 WO disclosed
WO-1998031687-A1 PROCESS FOR THE PREPARATION OF HETEROARYL-ZINC HALIDES ZAMBON GROUP S.P.A. (IT) 1998-07-23 WO disclosed
WO-1998028284-A1 PROCESS FOR THE PREPARATION OF HETEROARYL-PHENYLALANINES ZAMBON GROUP S.P.A. (IT) 1998-07-02 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-20240101542-A1 ERAP INHIBITORS ERAP2, ERAP1, ERMP1 KLK5 4112/4885CTSS 1354/4885CTSK 1240/4885
US-20250152658-A1 CYCLIC PEPTIDE FOR TRAPPING INTERLEUKIN-1 BETA IL1R1, IL1A, IL1B KLK5 2728/4885CTSS 1403/4885CTSK 1280/4885

“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.