SCHEMBL3012469

SCHEMBL3012469

COC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)O

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CASP1 P29466 5/20 0.56
ALDH1A1 P00352 1/20 0.56
ALOX15 P16050 1/20 0.56
CTSK P43235 4/20 0.55
KYNU Q16719 1/20 0.55
CTSS P25774 3/20 0.54
CTSL P07711 2/20 0.54
CTSB P07858 2/20 0.54
PPARG P37231 1/20 0.53
PPARA Q07869 1/20 0.53
TACR1 P25103 2/20 0.52
ATM Q13315 1/20 0.52
REN P00797 1/20 0.52

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
SCHEMBL8116799 1.00 CASP1 (0.56) CASP1ALDH1A1ALOX15CTSKKYNU
SCHEMBL3012475 1.00 CASP1 (0.56) CASP1ALDH1A1ALOX15CTSKKYNU
SCHEMBL12400686 0.91 KYNU (0.62) CASP1ALDH1A1ALOX15CTSKKYNU
SCHEMBL2617394 0.91 KYNU (0.62) CASP1ALDH1A1ALOX15CTSKKYNU
SCHEMBL2912589 0.91 CASP1 (0.60) CASP1ALDH1A1ALOX15CTSKCTSS
SCHEMBL7583002 0.91 CASP1 (0.60) CASP1ALDH1A1ALOX15CTSKCTSS
SCHEMBL2912586 0.91 CASP1 (0.60) CASP1ALDH1A1ALOX15CTSKCTSS
SCHEMBL14822417 0.89 CASP1 (0.54) CASP1ALDH1A1ALOX15CTSKKYNU
SCHEMBL7975561 0.89 CASP1 (0.55) CASP1ALDH1A1ALOX15CTSKKYNU
SCHEMBL755795 0.89 MMP9 (0.52) CASP1ALDH1A1ALOX15CTSKKYNU

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250025438-A1 Derivative of aspartic acid and use thereof in treatment of metabolic diseases such as hepatic fibrosis and non-alcoholic hepatitis SHENZHEN JINGTAI TECHNOLOGY CO., LTD. (CN) 2025-01-23 US disclosed
EP-4425181-A1 COMPOSITION FOR DETECTING OR MEASURING ANALYTE Bertis Inc (KR) 2024-09-04 EP disclosed
CN-118234705-A Aspartic acid derivative and application thereof in treatment of liver fibrosis, nonalcoholic hepatitis and other metabolic diseases 深圳利沃生物医药科技有限公司 2024-06-21 CN disclosed
US-11975076-B2 Antibody-drug conjugates comprising branched linkers and methods related thereto LEGOCHEM BIOSCIENCES, INC. (KR) 2024-05-07 US disclosed
EP-3380124-B1 CONJUGATES COMPRISING SELF-IMMOLATIVE GROUPS AND METHODS RELATED THERETO LEGOCHEM BIOSCIENCES INC (KR) 2024-04-03 EP disclosed
US-20240011979-A1 COMPOSITION FOR DETECTING OR MEASURING ANALYTES BERTIS INC. (KR) 2024-01-11 US disclosed
CN-117244076-A Conjugates comprising self-degrading groups and methods related thereto 乐高化学生物科学股份有限公司 2023-12-19 CN disclosed
CN-116829949-A Compositions for detecting or measuring analytes 伯蒂斯有限公司 2023-09-29 CN disclosed
US-20230234957-A1 PROTEIN TAG TO INDUCE LIGAND DEPENDENT DEGRADATION OF PROTEIN/PROTEIN-FUSIONS DANA-FARBER CANCER INSTITUTE, INC. (US) 2023-07-27 US disclosed
US-20230234957-A1 PROTEIN TAG TO INDUCE LIGAND DEPENDENT DEGRADATION OF PROTEIN/PROTEIN-FUSIONS DANA-FARBER CANCER INSTITUTE, INC. (US) 2023-07-27 US disclosed
EP-0346847-B1 Amino acid derivatives HOFFMANN LA ROCHE (CH) 1994-05-11 EP disclosed
US-5294713-A Inhibiting cell adhesion TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1994-03-15 US disclosed
EP-0321479-B1 ENZYMATIC MEMBRANE METHOD FOR THE SYNTHESIS AND SEPARATION OF PEPTIDES COCA COLA CO (US) 1994-03-09 EP disclosed
US-5202235-A Adjustment of equilibrium of charged and uncharged material THE COCA-COLA COMPANY (US) 1993-04-13 US disclosed
EP-0529858-A1 2-Piperazinone compounds, their production and use Takeda Chemical Industries, Ltd. (JP) 1993-03-03 EP disclosed
US-5157041-A Viricides HOFFMANN-LA ROCHE INC. (US) 1992-10-20 US disclosed
US-5037741-A Dipeptides such as aspartame, diffusion across an ion-rejection membrane THE COCA COLA COMPANY (US) 1991-08-06 US disclosed
US-5002871-A Enzymatic membrane method for the synthesis and separation of peptides THE COCA-COLA COMPANY (US) 1991-03-26 US disclosed
WO-1990012883-A1 ENZYMATIC MEMBRANE METHOD FOR THE SYNTHESIS AND SEPARATION OF PEPTIDES THE COCA-COLA COMPANY (US) 1990-11-01 WO disclosed
EP-0346847-A2 Amino acid derivatives F. HOFFMANN-LA ROCHE AG (CH) 1989-12-20 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 (3 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-11975076-B2 Antibody-drug conjugates comprising branched linkers and methods related thereto PA2G4, FCGRT, CLTB CASP1 4208/4885ALDH1A1 79/4885ALOX15 478/4885
US-20230234957-A1 PROTEIN TAG TO INDUCE LIGAND DEPENDENT DEGRADATION OF PROTEIN/PROTEIN-FUSIONS BET1, STUB1, MDM2 CASP1 3535/4885ALDH1A1 4453/4885ALOX15 4601/4885
US-20250025438-A1 Derivative of aspartic acid and use thereof in treatment of metabolic diseases such as hepatic fibrosis and non-alcoholic hepatitis GOT1, GOT2, GLS2 CASP1 662/4885ALDH1A1 38/4885ALOX15 887/4885

“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.