SCHEMBL970303

SCHEMBL970303

CCOC(=O)CC(=O)C(C)Br

nearest known ligand 0.58

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.58
MGAM O43451 1/20 0.58
SI P14410 1/20 0.58
MGAM2 Q2M2H8 1/20 0.58
ALDH1A1 P00352 4/20 0.48
TRPA1 O75762 1/20 0.48
LMNA P02545 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.38
CYP1A2 P05177 1/20 0.38
HSD17B10 Q99714 1/20 0.37
KMT2A Q03164 3/20 0.36
POLB P06746 1/20 0.36
ALOX15 P16050 2/20 0.36
SOAT1 P35610 1/20 0.36
KDM4E B2RXH2 1/20 0.35
MEN1 O00255 1/20 0.35

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
SCHEMBL6297051 0.84 GAA (0.61) GAAMGAMSIMGAM2ALDH1A1
Malonic Acid Diethyl Ester SCHEMBL27859816 0.84 GAA (0.75) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL13904711 0.83 FAAH (0.41) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL4467943 0.83 GAA (0.58) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL182126 0.82 GAA (0.64) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL2552735 0.81 GAA (0.56) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL12418382 0.81 GAA (0.56) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL4328506 0.81 ALDH1A1 (0.46) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL28825664 0.80 GAA (0.61) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL28048928 0.80 GAA (0.61) GAAMGAMSIMGAM2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1231482-C Process for preparing thiazolidinedione derivatives and intermediates HOFFMANN LA ROCHE (CH) 2005-12-14 CN claimed
EP-1282619-B1 PROCESSES FOR THE PREPARATION OF THIAZOLIDINEDIONE DERIVATIVES AND INTERMEDIATES HOFFMANN LA ROCHE (CH) 2005-06-22 EP claimed
US-20040024222-A1 Process for the preparation of thiazolidinedione derivatives SCALONE MICHELANGELO (CH) 2004-02-05 US claimed
CN-1422267-A Processes for the preparation of thiazolidinedione derivatives and intermediates HOFFMANN LA ROCHE (CH) 2003-06-04 CN claimed
US-20030092916-A1 Process for the preparation of thiazolidinedione derivatives SCALONE MICHELANGELO (CH) 2003-05-15 US claimed
EP-1282619-A1 PROCESSES FOR THE PREPARATION OF THIAZOLIDINEDIONE DERIVATIVES AND INTERMEDIATES F. HOFFMANN-LA ROCHE AG (CH) 2003-02-12 EP claimed
US-20010049445-A1 Process for the preparation of thiazolidinedione derivatives HOFFMANN-LA ROCHE INC. 2001-12-06 US claimed
WO-2001079202-A1 PROCESSES FOR THE PREPARATION OF THIAZOLIDINEDIONE DERIVATIVES AND INTERMEDIATES F. HOFFMANN-LA ROCHE AG (CH) 2001-10-25 WO claimed
EP-3865480-B1 HYDRAZINE DERIVATIVES FMC CORP (US) 2025-11-05 EP disclosed
CN-111018790-B Pyridazinone herbicides FMC公司 2023-09-19 CN disclosed
US-20230150996-A1 B-LACTAM COMPOUNDS, THEIR PREPARATION AND USE AS ANTIBACTERIAL AGENTS NINGXIA ACADEMY OF AGRICULTURE AND FORESTRY SCIENCES (CN) 2023-05-18 US disclosed
US-20230150996-A1 B-LACTAM COMPOUNDS, THEIR PREPARATION AND USE AS ANTIBACTERIAL AGENTS NINGXIA ACADEMY OF AGRICULTURE AND FORESTRY SCIENCES (CN) 2023-05-18 US disclosed
US-20230061841-A1 SHMT INHIBITORS AND USES THEREOF RAZE THERAPEUTICS, INC. 2023-03-02 US disclosed
US-20220348571-A1 DIHYDROPYRIMIDINE DERIVATIVES AND USES THEREOF IN THE TREATMENT OF HBV INFECTION OR OF HBV-INDUCED DISEASES JANSSEN SCIENCES IRELAND UNLIMITED CO (US) 2022-11-03 US disclosed
EP-1123936-A1 FUSED PYRIDAZINE DERIVATIVES, PROCESS FOR THE PREPARATION OF THE SAME AND USES THEREOF Takeda Chemical Industries, Ltd. (JP) 2001-08-16 EP disclosed
US-6248740-B1 FOR SUPPRESSION OF HISTAMINE OR EOSINOPHIL CHEMOTAXIS TO TREAT ASTHMA; ANTIALLERGENIC TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2001-06-19 US disclosed
EP-0979231-A1 CONDENSED PYRIDAZINE DERIVATIVES, THEIR PRODUCTION AND USE Takeda Chemical Industries, Ltd. (JP) 2000-02-16 EP disclosed
WO-1998049167-A1 CONDENSED PYRIDAZINE DERIVATIVES, THEIR PRODUCTION AND USE TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1998-11-05 WO disclosed
US-4943568-A Cephalosporins BAYER AKTIENGESELLSCHAFT (DE) 1990-07-24 US disclosed
EP-0223184-A2 Cephalosporins, process for their preparation and their use as medicaments BAYER AG (DE) 1987-05-27 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 (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-20230150996-A1 B-LACTAM COMPOUNDS, THEIR PREPARATION AND USE AS ANTIBACTERIAL AGENTS LBR, MRPL21, MRPL19 GAA 604/4885MGAM 19/4885SI 235/4885
US-20030092916-A1 Process for the preparation of thiazolidinedione derivatives SLC5A2, CYP4B1, CYP4F3 GAA 1358/4885MGAM 1533/4885SI 729/4885
US-20220348571-A1 DIHYDROPYRIMIDINE DERIVATIVES AND USES THEREOF IN THE TREATMENT OF HBV INFECTION OR OF HBV-INDUCED DISEASES DPYD, HAVCR2, TYMP GAA 1382/4885MGAM 4012/4885SI 1845/4885
US-20230061841-A1 SHMT INHIBITORS AND USES THEREOF SHMT1, SHMT2, BHMT GAA 1802/4885MGAM 1512/4885SI 2943/4885
US-20010049445-A1 Process for the preparation of thiazolidinedione derivatives SLC5A2, CYP4B1, CYP4F3 GAA 1358/4885MGAM 1533/4885SI 729/4885
US-20040024222-A1 Process for the preparation of thiazolidinedione derivatives SLC5A2, CYP4B1, CYP4F3 GAA 1358/4885MGAM 1533/4885SI 729/4885

“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.