SCHEMBL109480

SCHEMBL109480

COc1ccc([Mg]Br)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.58
CA2 P00918 2/20 0.58
CA7 P43166 2/20 0.58
CA9 Q16790 2/20 0.58
CA12 O43570 1/20 0.58
CA14 Q9ULX7 1/20 0.58
ACHE P22303 1/20 0.48
TDP1 Q9NUW8 3/20 0.46
MAPK1 P28482 3/20 0.46
ALDH1A1 P00352 3/20 0.44
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
KDM4E B2RXH2 1/20 0.44
GAA P10253 1/20 0.44
MAPT P10636 1/20 0.44
THRB P10828 1/20 0.44
RECQL P46063 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
CYP3A4 P08684 1/20 0.44

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
Bromide SCHEMBL1271263 0.97 CA1 (0.55) CA1CA2CA7CA9CA12
SCHEMBL9220678 0.97 CA1 (0.55) CA1CA2CA7CA9CA12
Tetrahydrofuran SCHEMBL7571357 0.84 SMN1; SMN2 (0.41) CA1CA2CA7CA9CA12
SCHEMBL4246695 0.80 CYP1A2 (0.54) MAPK1NPC1RAB9AKDM4EMAPT
SCHEMBL31308097 0.78 QPCT (0.43) ALDH1A1MAPTCYP3A4SMN1; SMN2IDO1
SCHEMBL11536088 0.78 CA1 (0.65) CA1CA2CA7CA9CA12
1,4-Dimethoxybenzene SCHEMBL8489 0.76 CA1 (1.00) CA1CA2CA7CA9CA12
SCHEMBL5487650 0.76
1,4-Dimethoxybenzene SCHEMBL21802643 0.76 CA1 (1.00) CA1CA2CA7CA9CA12
Lithium SCHEMBL2300586 0.76 CA1 (0.61) CA1CA2CA7CA9CA12

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 1684 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025242747-A1 MULTI -COMPONENT FORMULATIONS OF ORGANOMETALLIC REAGENTS MERCK PATENT GMBH (DE) 2025-11-27 WO claimed
CN-116768733-B Aryl cyclic ammonium salt arylation and silicon-based method 中国科学技术大学 2025-05-23 CN claimed
CN-118754917-B Alpha-diimine ligand compound, nickel complex, composite complex, preparation method and application thereof 安徽中科科乐化工科技有限责任公司 2025-01-17 CN claimed
CN-118908996-A A composition containing C (sp2) P bond or C (sp)3) Process for preparing organic phosphine compound of-P bond 烟台大学 2024-11-08 CN claimed
CN-118754917-A Alpha-diimine ligand compound, nickel complex, composite complex, preparation method and application thereof 安徽中科科乐化工科技有限责任公司 2024-10-11 CN claimed
CN-116768733-A Aryl cyclic ammonium salt arylation and silicon-based method 中国科学技术大学 2023-09-19 CN claimed
CN-114835755-B Catalyst of metal complex of biphosphinamide in catalytic polymerization, and preparation method 常州德能新材料有限公司 2023-08-18 CN claimed
CN-116410238-A Sulfur-containing chiral bridged metallocene compound, and preparation and application thereof 中国石油天然气股份有限公司 2023-07-11 CN claimed
WO-2023124996-A1 SULFUR-CONTAINING CHIRAL BRIDGED METALLOECENE COMPOUND, PREPARATION THEREOF, AND APPLICATION 中国石油天然气股份有限公司 2023-07-06 WO claimed
CN-113277972-B Synthesis of hole transport material based on diphenylamine substituted carbazole fluorene hybridization and application of hole transport material in perovskite solar cell 云南大学 2023-06-16 CN claimed
CN-1759084-A Process for preparing esters and ethers of probucol and derivatives thereof ATHEROGENICS INC (US) 2006-04-12 CN claimed
EP-1594824-A2 PROCESS OF PREPARING ESTERS AND ETHERS OF PROBUCOL AND DERIVATIVES THEREOF Atherogenics, Inc. (US) 2005-11-16 EP claimed
US-20040204485-A1 Process of preparing esters and ethers of probucol and derivatives thereof CRABTREE ACQUISITION CO, LLC 2004-10-14 US claimed
WO-2004062622-A2 PROCESS OF PREPARING ESTERS AND ETHERS OF PROBUCOL AND DERIVATIVES THEREOF ATHEROGENICS, INC. (US) 2004-07-29 WO claimed
EP-1120397-A2 Process for preparing triazole derivative KANEGAFUCHI KAGAKU KOGYO KABUSHIKI KAISHA (JP) 2001-08-01 EP claimed
US-6200503-B1 LOW-LOSS AND HIGH-BANDWIDTH OPTICAL FIBER CABLE THAT IS FLEXIBLE, RAPID, INEXPENSIVE, AND SIMPLE TO PRODUCE. KT HOLDINGS, LLC 2001-03-13 US claimed
EP-0958254-A4 GRADED INDEX POLYMER OPTICAL FIBERS AND PROCESS FOR MANUFACTURE THEREOF KATOOT MOHAMMAD W (US) 2001-01-10 EP claimed
EP-0958254-A1 GRADED INDEX POLYMER OPTICAL FIBERS AND PROCESS FOR MANUFACTURE THEREOF Katoot, Mohammed W. (US) 1999-11-24 EP claimed
WO-1998011287-A1 GRADED INDEX POLYMER OPTICAL FIBERS AND PROCESS FOR MANUFACTURE THEREOF KATOOT MOHAMMAD W (US) 1998-03-19 WO claimed
EP-0704419-A1 PROCESS FOR PRODUCING TRIAZOLE DERIVATIVE KANEGAFUCHI KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1996-04-03 EP claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 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-20040204485-A1 Process of preparing esters and ethers of probucol and derivatives thereof NR3C2, MGLL, GCG CA1 2271/4885CA2 1983/4885CA7 3712/4885

“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.