SCHEMBL3344606

SCHEMBL3344606

CCOC(=O)C(Br)(Br)C(=O)OCC

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.52
TRPA1 O75762 1/20 0.52
LMNA P02545 2/20 0.46
HSD17B10 Q99714 1/20 0.46
PIN1 Q13526 1/20 0.44
ALOX15 P16050 1/20 0.43
MGAM O43451 1/20 0.43
GAA P10253 1/20 0.43
SI P14410 1/20 0.43
MGAM2 Q2M2H8 1/20 0.43
SOAT1 P35610 1/20 0.43
PKM P14618 3/20 0.43
KDM4E B2RXH2 1/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
CYP4F2 P78329 2/20 0.42
CYP4A11 Q02928 2/20 0.42
THRB P10828 1/20 0.42
TSHR P16473 2/20 0.41
CYP1A2 P05177 2/20 0.41

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
SCHEMBL7512919 0.87 PIN1 (0.44) ALDH1A1TRPA1LMNAHSD17B10PIN1
SCHEMBL6297048 0.87 ALDH1A1 (0.46) ALDH1A1TRPA1LMNAHSD17B10PIN1
SCHEMBL297524 0.83
SCHEMBL24414295 0.81
SCHEMBL2321956 0.81
SCHEMBL36821 0.81
SCHEMBL653853 0.81 ALDH1A1 (0.46) ALDH1A1TRPA1LMNAHSD17B10PIN1
SCHEMBL7531627 0.79 MEN1 (0.45) ALDH1A1TRPA1LMNAHSD17B10PIN1
Methane SCHEMBL21632462 0.79 CYP4F2 (0.44) ALDH1A1TRPA1LMNAHSD17B10PIN1
SCHEMBL1086891 0.79

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118908877-A Free radical polymerization photocatalyst based on diphenylcarbazole, preparation method and photocuring application thereof 西安交通大学 2024-11-08 CN claimed
CN-115732783-A Composite metal lithium cathode with artificial solid electrolyte interface layer and preparation method and application thereof 电子科技大学长三角研究院(湖州) 2023-03-03 CN claimed
EP-3377470-B1 PROCESS FOR THE SYNTHESIS OF INTERMEDIATES USEFUL FOR PREPARING 1,3,4-TRIAZINE DERIVATIVES FMC CORP (US) 2020-11-11 EP claimed
US-10294196-B2 Process for the synthesis of intermediates useful for preparing 1,3,4-triazine derivatives FMC CORP (US) 2019-05-21 US claimed
US-20180334427-A1 Process for the Synthesis of Intermediates Useful for Preparing 1,3,4-Triazine Derivatives FMC CORP (US) 2018-11-22 US claimed
EP-3377470-A1 PROCESS FOR THE SYNTHESIS OF INTERMEDIATES USEFUL FOR PREPARING 1,3,4-TRIAZINE DERIVATIVES FMC Corporation (US) 2018-09-26 EP claimed
CN-108349868-A Method for synthesizing the intermediate that can be used for preparing 1,3,4- triazines FMC有限公司 2018-07-31 CN claimed
CN-116507610-B Herbicidal malonamides 巴斯夫欧洲公司 2026-05-19 CN disclosed
CN-121378334-A Phosphonyl compound and synthesis method and application thereof 湖北大学 2026-01-23 CN disclosed
EP-4251609-B1 HERBICIDAL MALONAMIDES BASF SE (DE) 2025-04-23 EP disclosed
CN-118908877-A Free radical polymerization photocatalyst based on diphenylcarbazole, preparation method and photocuring application thereof 西安交通大学 2024-11-08 CN disclosed
CN-116606239-B Photo-induced CBr4Preparation method for constructing 3-bromo-spiro [4,5] triene ketone compound 三峡大学 2024-10-18 CN disclosed
CN-115636796-B Preparation method of fampicin 新发药业有限公司 2024-06-18 CN disclosed
EP-0597329-B1 Process for the preparation of alpha-fluor-beta dicarbonyle compounds BAYER AG (DE) 1997-02-05 EP disclosed
WO-1996039367-A1 HETEROCYCLIC METHYL FREE RADICALS AS IMAGE ENHANCING AGENTS NYCOMED IMAGING A/S (NO) 1996-12-12 WO disclosed
US-5391811-A Process for the preparation of α-fluoro-β-dicarbonyl compounds BAYER AKTIENGESELLSCHAFT (DE) 1995-02-21 US disclosed
EP-0416810-B1 Cephalosporin compounds, process for their preparation, pharmaceutical compositions and intermediates BEECHAM GROUP PLC (GB) 1995-02-08 EP disclosed
EP-0597329-A2 Process for the preparation of alpha-fluor-beta dicarbonyle compounds BAYER AG (DE) 1994-05-18 EP disclosed
US-5275816-A Cephalosporin derivatives BEECHAM GROUP P.L.C. (GB) 1994-01-04 US disclosed
EP-0416810-A2 Cephalosporin compounds, process for their preparation, pharmaceutical compositions and intermediates Beecham Group p.l.c. (GB) 1991-03-13 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 (2 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-10294196-B2 Process for the synthesis of intermediates useful for preparing 1,3,4-triazine derivatives DAZAP1, TALDO1, GMDS ALDH1A1 395/4885TRPA1 4022/4885LMNA 3909/4885
US-20180334427-A1 Process for the Synthesis of Intermediates Useful for Preparing 1,3,4-Triazine Derivatives DHPS, CYP4Z1, NISCH ALDH1A1 800/4885TRPA1 4466/4885LMNA 2871/4885

“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.