SCHEMBL45626

SCHEMBL45626

CC(CCNC(=O)OC(C)(C)C)C(=O)O

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.65
GAA P10253 1/20 0.65
KMT2A Q03164 1/20 0.65
TDP1 Q9NUW8 1/20 0.50
MAOA P21397 1/20 0.44
MAOB P27338 1/20 0.44
GABRR1 P24046 2/20 0.44
CTSS P25774 4/20 0.42
CTSK P43235 4/20 0.42
CA1 P00915 3/20 0.42
CA2 P00918 3/20 0.42
CA12 O43570 2/20 0.42
CA9 Q16790 2/20 0.42
EPHX1 P07099 1/20 0.42
CA7 P43166 1/20 0.41
KCNA5 P22460 1/20 0.40
CTSL P07711 1/20 0.40
CTSB P07858 1/20 0.40
MALT1 Q9UDY8 1/20 0.40
IDO1 P14902 1/20 0.40

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
SCHEMBL7882078 1.00 MEN1 (0.65) MEN1GAAKMT2ATDP1MAOA
SCHEMBL15723436 1.00 MEN1 (0.65) MEN1GAAKMT2ATDP1MAOA
SCHEMBL18251805 0.90 MEN1 (0.58) MEN1GAAKMT2ATDP1MAOA
SCHEMBL23417829 0.90 MEN1 (0.76) MEN1GAAKMT2ATDP1MAOA
SCHEMBL12571330 0.90 MEN1 (0.76) MEN1GAAKMT2ATDP1MAOA
SCHEMBL15082199 0.90 MEN1 (0.76) MEN1GAAKMT2ATDP1MAOA
SCHEMBL12787794 0.88 MEN1 (0.69) MEN1GAAKMT2ATDP1MAOA
SCHEMBL9945627 0.88 MEN1 (0.69) MEN1GAAKMT2ATDP1MAOA
SCHEMBL12762769 0.88 MEN1 (0.69) MEN1GAAKMT2ATDP1MAOA
SCHEMBL18251802 0.87 MEN1 (0.67) MEN1GAAKMT2ATDP1MAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4695271-A2 A CYCLIC PEPTIDE FOR TRAPPING INTERLEUKIN-1 BETA Merck Sharp & Dohme LLC (US) 2026-02-18 EP disclosed
CN-119866342-A Cyclic peptides for capturing interleukin-1 beta 默沙东有限责任公司 2025-04-22 CN disclosed
US-20240398966-A1 CONJUGATES AND METHODS OF USING THE SAME FLAGSHIP PIONEERING INNOVATIONS V INC (US) 2024-12-05 US disclosed
WO-2024215820-A2 A CYCLIC PEPTIDE FOR TRAPPING INTERLEUKIN-1 BETA MERCK SHARP & DOHME LLC (US) 2024-10-17 WO disclosed
US-11998610-B2 Conjugates and methods of using the same FLAGSHIP PIONEERING INNOVATIONS V, INC. (US) 2024-06-04 US disclosed
EP-3210627-B1 CONJUGATES OF CELL BINDING MOLECULES WITH CYTOTOXIC AGENTS HANGZHOU DAC BIOTECH CO LTD (CN) 2022-12-21 EP disclosed
US-20220204495-A1 INHIBITING TRABID Valo Health, LLC 2022-06-30 US disclosed
EP-3854789-A1 MACROCYCLIC COMPOUNDS USEFUL AS CHITINASE INHIBITORS CYGNET BIOSCIENCES B.V. (CW) 2021-07-28 EP disclosed
EP-3305900-B1 ENZYMATIC ENCODING METHODS FOR EFFICIENT SYNTHESIS OF LARGE LIBRARIES NUEVOLUTION AS (DK) 2021-07-21 EP disclosed
EP-3836971-A1 CONJUGATES AND METHODS OF USING THE SAME Flagship Pioneering Innovations V, Inc. (US) 2021-06-23 EP disclosed
US-20210162057-A1 CONJUGATES AND METHODS OF USING THE SAME FLAGSHIP PIONEERING INNOVATIONS V, INC. 2021-06-03 US disclosed
WO-2020227168-A1 INHIBITING TRABID INTEGRAL EARLY DISCOVERY, INC. (US) 2020-11-12 WO disclosed
WO-2020227168-A1 INHIBITING TRABID INTEGRAL EARLY DISCOVERY, INC. (US) 2020-11-12 WO disclosed
WO-2020037009-A1 CONJUGATES AND METHODS OF USING THE SAME FLAGSHIP PIONEERING INNOVATIONS V, INC. (US) 2020-02-20 WO disclosed
US-9150899-B2 Identification of compounds modifying a cellular response 2CUREX (DK) 2015-10-06 US disclosed
US-20130123140-A1 IDENTIFICATION OF COMPOUNDS MODIFYING A CELLULAR RESPONSE 2CUREX (DK) 2013-05-16 US disclosed
WO-2012025502-A1 NEW PROCESS FOR THE PREPARATION OF INTERMEDIATES USEFUL FOR THE MANUFACTURE NEP INHIBITORS NOVARTIS AG (CH) 2012-03-01 WO disclosed
US-20070265240-A1 Sequence Selective Pyrrole and Imidazole Polyamide Metallocomplexes UNIVERSITY OF WESTERN SYDNEY (AU) 2007-11-15 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 (5 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-11998610-B2 Conjugates and methods of using the same CD47, CD44, CD74 MEN1 2346/4885GAA 197/4885KMT2A 3520/4885
US-20220204495-A1 INHIBITING TRABID TPO, PRKACG, NFKBIA MEN1 1395/4885GAA 381/4885KMT2A 4796/4885
US-20070265240-A1 Sequence Selective Pyrrole and Imidazole Polyamide Metallocomplexes POLRMT, MPI, PPIF MEN1 563/4885GAA 1214/4885KMT2A 1205/4885
US-20210162057-A1 CONJUGATES AND METHODS OF USING THE SAME CD47, CD44, CD74 MEN1 2346/4885GAA 197/4885KMT2A 3520/4885
US-20240398966-A1 CONJUGATES AND METHODS OF USING THE SAME CD47, CD44, CD74 MEN1 2346/4885GAA 197/4885KMT2A 3520/4885

“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.