SCHEMBL343679

SCHEMBL343679

CC(C)(C)OC(=O)CC(NC(=O)OC(C)(C)C)C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 1/20 0.55
CTSK P43235 7/20 0.49
CTSS P25774 6/20 0.49
PPARA Q07869 6/20 0.47
PPARG P37231 5/20 0.47
CTSL P07711 1/20 0.47
CTSB P07858 1/20 0.47
ACE P12821 1/20 0.46
CYP1A2 P05177 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
HTT P42858 1/20 0.46
PPARD Q03181 2/20 0.45
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
CA7 P43166 1/20 0.45
MEN1 O00255 1/20 0.44
GAA P10253 1/20 0.44
KMT2A Q03164 1/20 0.44
IDO1 P14902 1/20 0.43

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
SCHEMBL343678 1.00 CYP2D6 (0.55) CYP2D6CTSKCTSSPPARAPPARG
SCHEMBL3682214 1.00 CYP2D6 (0.55) CYP2D6CTSKCTSSPPARAPPARG
SCHEMBL344762 0.91 CTSK (0.48) CYP2D6CTSKCTSSPPARAPPARG
SCHEMBL2018992 0.91 CTSK (0.48) CYP2D6CTSKCTSSPPARAPPARG
SCHEMBL344763 0.91 CTSK (0.48) CYP2D6CTSKCTSSPPARAPPARG
Hydrochloric Acid SCHEMBL25223717 0.90 CTSK (0.47) CYP2D6CTSKCTSSPPARAPPARG
Hydrochloric Acid SCHEMBL25223716 0.90 CTSK (0.47) CYP2D6CTSKCTSSPPARAPPARG
SCHEMBL1486220 0.87 CTSS (0.50) CYP2D6CTSKCTSSPPARAPPARG
SCHEMBL3323682 0.87 CTSS (0.50) CYP2D6CTSKCTSSPPARAPPARG
SCHEMBL688341 0.87 CTSS (0.50) CYP2D6CTSKCTSSPPARAPPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-122010782-A Gelagliptin intermediate Process for the preparation of bulk compounds 四川定科制药有限公司 2026-05-12 CN claimed
CN-117682981-A Preparation method of gemagliptin prodrug 中国科学院大连化学物理研究所 2024-03-12 CN claimed
CN-112480122-B Tetrahydroimidazo [1,2-a ] pyrazine compound, composition, preparation method and application thereof 中山大学 2022-03-22 CN claimed
CN-104593173-A Detergent for grapes YANTAI SHUNLONG CHEMICAL TECHNOLOGY CO LTD 2015-05-06 CN claimed
CN-122010782-A Gelagliptin intermediate Process for the preparation of bulk compounds 四川定科制药有限公司 2026-05-12 CN disclosed
CN-122010782-A Gelagliptin intermediate Process for the preparation of bulk compounds 四川定科制药有限公司 2026-05-12 CN disclosed
US-20260007758-A1 SOMATOSTATIN SUBTYPE-2 RECEPTOR (SST2R) NON-PEPTIDE DRUG CONJUGATES AND USES THEREOF CRINETICS PHARMACEUTICALS INC (US) 2026-01-08 US disclosed
US-20260008750-A1 COMPOUNDS, COMPOSITIONS, AND METHODS FOR REDUCING PRODUCTION OF TRIMETHYLAMINE CLEVELAND CLINIC FOUND (US) 2026-01-08 US disclosed
US-20250213685-A1 ANTI-EGFR ANTIBODY DRUG CONJUGATES ABBVIE INC (US) 2025-07-03 US disclosed
US-20250177374-A1 BCL-XL Inhibitory Compounds Having Low Cell Permeability and Antibody Drug Conjugates Including the Same ABBVIE INC (US) 2025-06-05 US disclosed
US-20250136563-A1 THIADIAZOLONE DERIVATIVES USEFUL AS AMPK ACTIVATOR BETAGENON AB (SE) 2025-05-01 US disclosed
CN-119841819-A Degradation agent for targeting BCR-ABL and application thereof 北京大学 2025-04-18 CN disclosed
EP-0757677-B1 BENZOCYCLOHEXYLIMIDAZOLETHIONE DERIVATIVES SYNTEX LLC (US) 2003-06-18 EP disclosed
CN-1420881-A Beta-amino acid derivs. as inhibitors of matrix metalloproteases and TNF-alpha BRISTOL MYERS SQUIBB PHARMACEU (US) 2003-05-28 CN disclosed
EP-1263756-A2 BETA-AMINO ACID DERIVATIVES AS INHIBITORS OF MATRIX METALLOPROTEASES AND TNF-ALPHA Bristol-Myers Squibb Pharma Company (US) 2002-12-11 EP disclosed
WO-2001070734-A2 BETA-AMINO ACID DERIVATIVES AS INHIBITORS OF MATRIX METALLOPROTEASES AND TNF-ALPHA BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2001-09-27 WO disclosed
US-5719280-A REACTING AMINE SUBSTITUTED BENZOCYCLOALKANE WITH DIALKYLOXYACETALDEHYDE IN PRESENCE OF REDUCING AGENT OR CATALYTIC HYDROGENATION, TREATING WITH THIOCYANIC ACID SYNTEX (U.S.A.) INC. (US) 1998-02-17 US disclosed
EP-0757677-A1 BENZOCYCLOALKYLAZOLETHIONE DERIVATIVES SYNTEX (U.S.A.) INC. (US) 1997-02-12 EP disclosed
US-5538988-A CARDIOVASCULAR DISORDERS AND DOPAMINE HYDROLASE ENZYME INHIBITORS SYNTEX (U.S.A.) INC. 1996-07-23 US disclosed
WO-1995029165-A2 BENZOCYCLOALKYLAZ0LETHIONE DERIVATIVES AS DOPAMIN BETA-HYDROXYLASE INHIBITORS SYNTEX (U.S.A.) INC. (US) 1995-11-02 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 (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-20250213685-A1 ANTI-EGFR ANTIBODY DRUG CONJUGATES EGFR, ERBB2, ERBB3 CYP2D6 2451/4885CTSK 894/4885CTSS 796/4885
US-20260008750-A1 COMPOUNDS, COMPOSITIONS, AND METHODS FOR REDUCING PRODUCTION OF TRIMETHYLAMINE SLC6A6, BHMT2, BHMT CYP2D6 642/4885CTSK 3175/4885CTSS 3769/4885
US-20250136563-A1 THIADIAZOLONE DERIVATIVES USEFUL AS AMPK ACTIVATOR PRKAB1, PRKAG1, PRKAA1 CYP2D6 1841/4885CTSK 2422/4885CTSS 4104/4885
US-20260007758-A1 SOMATOSTATIN SUBTYPE-2 RECEPTOR (SST2R) NON-PEPTIDE DRUG CONJUGATES AND USES THEREOF SSTR4, SSTR1, SSTR3 CYP2D6 826/4885CTSK 3459/4885CTSS 2668/4885
US-20250177374-A1 BCL-XL Inhibitory Compounds Having Low Cell Permeability and Antibody Drug Conjugates Including the Same BCL2, BAX, BCL9 CYP2D6 2010/4885CTSK 1001/4885CTSS 1222/4885

“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.