SCHEMBL583877

SCHEMBL583877

CC(C)(C)OC(=O)N[C@H](C(=O)O)C1(C)CCCCC1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CTSK P43235 10/20 0.39
CTSS P25774 6/20 0.39
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA7 P43166 1/20 0.38
KMT2A Q03164 2/20 0.37
GAA P10253 2/20 0.37
MEN1 O00255 1/20 0.37
CTSL P07711 2/20 0.36
BTK Q06187 1/20 0.35
CYP2D6 P10635 1/20 0.35
CTSB P07858 1/20 0.35
HDAC4 P56524 1/20 0.34
HDAC1 Q13547 1/20 0.34
HDAC6 Q9UBN7 1/20 0.34

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
SCHEMBL583878 1.00 CTSK (0.39) CTSKCTSSCA1CA2CA7
SCHEMBL1492103 1.00 CTSK (0.39) CTSKCTSSCA1CA2CA7
SCHEMBL31374987 0.98 CA1 (0.39) CTSKCTSSCA1CA2CA7
SCHEMBL1480407 0.98 CA1 (0.39) CTSKCTSSCA1CA2CA7
SCHEMBL28269476 0.95 CA1 (0.39) CTSKCTSSCA1CA2CA7
SCHEMBL15105800 0.95 CA1 (0.39) CTSKCTSSCA1CA2CA7
SCHEMBL2377942 0.93 CA1 (0.40) CTSKCTSSCA1CA2CA7
SCHEMBL15105955 0.93 CA1 (0.40) CTSKCTSSCA1CA2CA7
SCHEMBL2377936 0.93 CA1 (0.40) CTSKCTSSCA1CA2CA7
SCHEMBL14899075 0.89 CA1 (0.37) CTSKCTSSCA1CA2CA7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025011610-A1 AMIDE DERIVATIVE, AND COMPOSITION AND USE THEREOF 深圳市塔吉瑞生物医药有限公司 2025-01-16 WO disclosed
CN-119306790-A Amide derivative, composition and use thereof 深圳市塔吉瑞生物医药有限公司 2025-01-14 CN disclosed
US-20230312571-A1 RING-MODIFIED PROLINE SHORT PEPTIDE COMPOUND AND USE THEREOF FUJIAN AKEYLINK BIOTECHNOLOGY CO., LTD. (CN) 2023-10-05 US disclosed
EP-4209494-A1 RING-MODIFIED PROLINE SHORT PEPTIDE COMPOUND AND USE THEREOF Fujian Akeylink Biotechnology Co., Ltd. (CN) 2023-07-12 EP disclosed
EP-2780026-B1 HCV NS3 PROTEASE INHIBITORS MERCK SHARP & DOHME (US) 2019-10-23 EP disclosed
EP-2780026-B1 HCV NS3 PROTEASE INHIBITORS MERCK SHARP & DOHME (US) 2019-10-23 EP disclosed
EP-2417108-B1 ORGANIC COMPOUNDS AND THEIR USES NOVARTIS AG (CH) 2016-08-17 EP disclosed
US-9328138-B2 HCV NS3 protease inhibitors MSD ITALIA S.R.L. (IT) 2016-05-03 US disclosed
US-9328138-B2 HCV NS3 protease inhibitors MSD ITALIA S.R.L. (IT) 2016-05-03 US disclosed
US-9206232-B2 Organic compounds and their uses NOVARTIS AG (CH) 2015-12-08 US disclosed
US-20130190229-A1 VITAMIN E FORMULATIONS OF SULFAMIDE NS3 INHIBITORS NOVARTIS INSTITUTES FOR BIOMEDICAL RESEARCH, INC. 2013-07-25 US disclosed
WO-2013074386-A2 HCV NS3 PROTEASE INHIBITORS MERCK SHARP & DOHME CORP. (US) 2013-05-23 WO disclosed
WO-2013074386-A2 HCV NS3 PROTEASE INHIBITORS MERCK SHARP & DOHME CORP. (US) 2013-05-23 WO disclosed
US-20130034519-A1 ORGANIC COMPOUNDS AND THEIR USES NOVARTIS AG (CH) 2013-02-07 US disclosed
US-20130022572-A1 ORGANIC COMPOUNDS AND THEIR USES NOVARTIS AG (CH) 2013-01-24 US disclosed
WO-2012048235-A1 VITAMIN E FORMULATIONS OF SULFAMIDE NS3 INHIBITORS NOVARTIS AG (CH) 2012-04-12 WO disclosed
EP-2417108-A1 ORGANIC COMPOUNDS AND THEIR USES Novartis AG (CH) 2012-02-15 EP disclosed
WO-2010116248-A1 ORGANIC COMPOUNDS AND THEIR USES NOVARTIS AG (CH) 2010-10-14 WO disclosed
US-20100260709-A1 ORGANIC COMPOUNDS AND THEIR USES NOVARTIS AG (CH) 2010-10-14 US disclosed
US-20090186869-A1 Antiviral compounds GILEAD SCIENCES, INC. (US) 2009-07-23 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 (6 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-20130022572-A1 ORGANIC COMPOUNDS AND THEIR USES OAT, OTC, AOX1 CTSK 1630/4885CTSS 1782/4885CA1 2516/4885
US-20100260709-A1 ORGANIC COMPOUNDS AND THEIR USES OAT, OTC, AOX1 CTSK 1630/4885CTSS 1782/4885CA1 2516/4885
US-20130034519-A1 ORGANIC COMPOUNDS AND THEIR USES OAT, OTC, AOX1 CTSK 1630/4885CTSS 1782/4885CA1 2516/4885
US-20090186869-A1 Antiviral compounds MAVS, EIF2AK2, ZC3HAV1 CTSK 1314/4885CTSS 925/4885CA1 4745/4885
US-20230312571-A1 RING-MODIFIED PROLINE SHORT PEPTIDE COMPOUND AND USE THEREOF VIP, PREP, PRAP1 CTSK 1121/4885CTSS 2039/4885CA1 2286/4885
US-20130190229-A1 VITAMIN E FORMULATIONS OF SULFAMIDE NS3 INHIBITORS TTPA, SULT1E1, SQOR CTSK 1225/4885CTSS 454/4885CA1 4872/4885

“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.