SCHEMBL118384

SCHEMBL118384

CC(C)(C)OC(=O)NCC(C(=O)O)c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CTSK P43235 5/20 0.51
CTSS P25774 4/20 0.51
SYK P43405 1/20 0.51
MEN1 O00255 1/20 0.45
GAA P10253 1/20 0.45
KMT2A Q03164 1/20 0.45
ATM Q13315 1/20 0.45
MALT1 Q9UDY8 1/20 0.44
IDO1 P14902 1/20 0.44
CTSL P07711 1/20 0.43
CTSB P07858 1/20 0.43
KDM4A O75164 1/20 0.43
MAPT P10636 1/20 0.43
CA12 O43570 1/20 0.43
CA1 P00915 1/20 0.43
CA7 P43166 1/20 0.43
CA14 Q9ULX7 1/20 0.43
PPARA Q07869 2/20 0.42
PPARG P37231 1/20 0.42

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
SCHEMBL266022 1.00 CTSK (0.51) CTSKCTSSSYKMEN1GAA
SCHEMBL266021 1.00 CTSK (0.51) CTSKCTSSSYKMEN1GAA
SCHEMBL27414019 0.92 CTSS (0.48) CTSKCTSSSYKMEN1GAA
SCHEMBL12028293 0.90 CTSK (0.50) CTSKCTSSSYKMEN1GAA
SCHEMBL20777776 0.89 CTSS (0.50) CTSKCTSSSYKATMMALT1
SCHEMBL5669913 0.88 CTSK (0.49) CTSKCTSSSYKATMMALT1
SCHEMBL7760725 0.88 CTSK (0.49) CTSKCTSSSYKMEN1GAA
SCHEMBL27406072 0.88 SYK (0.52) CTSKCTSSSYKKMT2AATM
SCHEMBL6531538 0.88 SYK (0.52) CTSKCTSSSYKKMT2AATM
SCHEMBL7757520 0.88 CTSK (0.49) CTSKCTSSSYKMEN1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250346616-A1 ROCK INHIBITORS AND USES THEREOF DIZAL JIANGSU PHARMACEUTICAL CO LTD (CN) 2025-11-13 US disclosed
EP-3845276-B1 BETA-AMINO ACID DERIVATIVE, KINASE INHIBITOR AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME, AND USE OF THE SAME IND TECH RES INST (TW) 2025-01-29 EP disclosed
CN-113121443-B Beta-amino acid derivatives, kinase inhibitors and pharmaceutical compositions containing them and their use 财团法人工业技术研究院 2024-07-09 CN disclosed
CN-117551004-A Synthesis method of amino acid and amino alcohol compound 四川大学 2024-02-13 CN disclosed
WO-2023226965-A1 ROCK INHIBITORS AND USES THEREOF DIZAL (JIANGSU) PHARMACEUTICAL CO., LTD. (CN) 2023-11-30 WO disclosed
US-20230159538-A1 PYRROLIDINE-PYRAZOLES AS PYRUVATE KINASE ACTIVATORS GLOBAL BLOOD THERAPEUTICS, INC. 2023-05-25 US disclosed
US-11608319-B2 Beta-amino acid derivative, kinase inhibitor and pharmaceutical composition containing the same, and method for performing an in vivo related application that benefits from the inhibition of a kinase INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2023-03-21 US disclosed
US-20230065368-A1 INHIBITING UBIQUITIN SPECIFIC PEPTIDASE 9X FORMA THERAPEUTICS, INC. 2023-03-02 US disclosed
EP-4126876-A1 PYRROLIDINE-PYRAZOLES AS PYRUVATE KINASE ACTIVATORS Global Blood Therapeutics, Inc. (US) 2023-02-08 EP disclosed
US-20220363645-A1 BETA-AMINO ACID DERIVATIVE, KINASE INHIBITOR AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME, AND METHOD FOR PERFORMING AN IN VIVO RELATED APPLICATION THAT BENEFITS FROM THE INHIBITION OF A KINASE INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2022-11-17 US disclosed
WO-2007076423-A2 INHIBITORS OF Akt ACTIVITY SMITHKLINE BEECHAM CORPORATION (US) 2007-07-05 WO disclosed
CN-1148367-C Amidine derivatives, their preparation and application as medicines and pharmaceutical compositions containing same ��ѧ�о���Ӧ����ѯ��˾ 2004-05-05 CN disclosed
US-20040049008-A1 Templated molecules and methods for using such molecules NUEVOLUTION A/S (DK) 2004-03-11 US disclosed
US-20030143561-A1 Nucleoside derivatives for library preparation NUEVOLUTION A/S (DK) 2003-07-31 US disclosed
EP-0445796-B1 Derivatives of acetic acid containing peptide bonds HOFFMANN LA ROCHE (CH) 1998-06-17 EP disclosed
US-5430024-A Peptides bearing N-terminal amidino moieties and their use as inhibitors of platelet aggregation HOFFMANN-LA ROCHE INC. (US) 1995-07-04 US disclosed
US-5273982-A An amidinoaryleneamidoalkylpiperazinyleneacetic acid HOFFMANN-LA ROCHE INC. (US) 1993-12-28 US disclosed
US-5102667-A Antiallergens, antiinflammatory agents, nervous system disorders, immunology, psychological disorders RHONE-POULENC SANTE (FR) 1992-04-07 US disclosed
EP-0445796-A2 Derivatives of acetic acid F. HOFFMANN-LA ROCHE AG (CH) 1991-09-11 EP disclosed
EP-0386839-A2 Tetrahydroquinoline derivatives useful for neurodegenerative disorders MERCK SHARP & DOHME LTD. (GB) 1990-09-12 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 (7 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-20250346616-A1 ROCK INHIBITORS AND USES THEREOF ROCK1, ROCK2, RHOA CTSK 1192/4885CTSS 2671/4885SYK 1211/4885
US-20040049008-A1 Templated molecules and methods for using such molecules INTS6, ABL1, INMT CTSK 2238/4885CTSS 1399/4885SYK 2280/4885
US-20230065368-A1 INHIBITING UBIQUITIN SPECIFIC PEPTIDASE 9X USP9X, USP19, USP39 CTSK 877/4885CTSS 693/4885SYK 4090/4885
US-20030143561-A1 Nucleoside derivatives for library preparation PNP, SAMHD1, DCTD CTSK 2345/4885CTSS 2836/4885SYK 4491/4885
US-11608319-B2 Beta-amino acid derivative, kinase inhibitor and pharmaceutical composition containing the same, and method for performing an in vivo related application that benefits from the inhibition of a kinase CSNK1A1, CSNK1D, CSNK1G3 CTSK 694/4885CTSS 1647/4885SYK 749/4885
US-20220363645-A1 BETA-AMINO ACID DERIVATIVE, KINASE INHIBITOR AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME, AND METHOD FOR PERFORMING AN IN VIVO RELATED APPLICATION THAT BENEFITS FROM THE INHIBITION OF A KINASE CSNK1A1, CSNK1D, CSNK1G3 CTSK 694/4885CTSS 1647/4885SYK 749/4885
US-20230159538-A1 PYRROLIDINE-PYRAZOLES AS PYRUVATE KINASE ACTIVATORS PDK1, PDK2, PKM CTSK 2102/4885CTSS 4325/4885SYK 1331/4885

“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.