SCHEMBL24031

SCHEMBL24031

COc1cccc([Mg]Br)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.50
CA1 P00915 1/20 0.48
CA2 P00918 1/20 0.48
CA7 P43166 1/20 0.48
CA9 Q16790 1/20 0.48
ALDH1A1 P00352 1/20 0.48
CYP3A4 P08684 1/20 0.48
CES2 O00748 1/20 0.44
CES1 P23141 1/20 0.44
ENPP2 Q13822 1/20 0.44
CHRM5 P08912 1/20 0.42
CA4 P22748 1/20 0.42
IDO1 P14902 2/20 0.41
AGXT P21549 2/20 0.41
TAAR1 Q96RJ0 2/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
PARP1 P09874 1/20 0.41
RELA Q04206 1/20 0.41
SMN1; SMN2 Q16637 1/20 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
SCHEMBL29411044 1.00 ACHE (0.50) ACHECA1CA2CA7CA9
Lithium Ion SCHEMBL4449956 0.89 ACHE (0.41) ACHECA1CA2CA7CA9
SCHEMBL635049 0.79 ABL1 (0.58) ALDH1A1CYP3A4NPC1RAB9ASMN1; SMN2
SCHEMBL9457403 0.79 MAOB (0.36) CYP3A4MAOB
SCHEMBL1794814 0.78 ACHE (0.50) ACHECA1CA2CA7CA9
Hydrochloric Acid SCHEMBL8086769 0.78 ACHE (0.50) ACHECA1CA2CA7CA9
SCHEMBL3138349 0.78 TP53 (0.53) ALDH1A1CYP3A4SMN1; SMN2
SCHEMBL635453 0.78 RXRA (0.42) CA2ALDH1A1NPC1RAB9ARELA
SCHEMBL7265757 0.77 LTA4H (0.50) ALDH1A1SMN1; SMN2MAOB
Bromide SCHEMBL10653968 0.77 ACHE (0.48) ACHECA1CA2CA7CA9

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 949 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-119060007-A Preparation and application of fluorescence donor capable of controllably releasing hydrogen sulfide and carbon monoxide 广西中医药大学 2024-12-03 CN claimed
CN-115260043-B Synthesis method of meta-hydroxylamine bitartrate 海南长春花药业有限公司 2024-03-22 CN claimed
CN-115701422-B Preparation method of KGP94 中国科学院昆明植物研究所 2024-02-09 CN claimed
CN-114436790-B Synthesis method of 6-methoxy-1-tetralone 浙江仙居君业药业有限公司 2023-05-05 CN claimed
CN-115701422-A Preparation method of KGP94 中国科学院昆明植物研究所 2023-02-10 CN claimed
CN-115260043-A Synthesis method of meta-hydroxylamine bitartrate 海南长春花药业有限公司 2022-11-01 CN claimed
CN-114436790-A Synthesis method of 6-methoxy-1-tetralone 浙江仙居君业药业有限公司 2022-05-06 CN claimed
CN-101265201-B Method for synthesizing tramadol hydrochloride UNIV ZHEJIANG TECHNOLOGY 2011-11-23 CN claimed
CN-100548950-C Process for preparing esters and ethers of probucol and derivatives thereof ATHEROGENICS INC (US) 2009-10-14 CN claimed
US-20070112074-A1 Tramadol recovery process IPCA LABORATORIES LIMITED (IN) 2007-05-17 US claimed
EP-1785412-A1 Tramadol recovery process IPCA Laboratories Limited (IN) 2007-05-16 EP claimed
EP-1594824-A4 PROCESS OF PREPARING ESTERS AND ETHERS OF PROBUCOL AND DERIVATIVES THEREOF ATHEROGENICS INC (US) 2007-04-04 EP 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-0778262-B1 Process for the purification of (RR-SS)-2-dimethyl-aminomethyl-1-(3-methoxyphenyl)cyclohexanol and its salts CHEMAGIS LTD (IL) 2001-01-24 EP claimed
US-5672755-A Process for the purification of (RR-SS)-2-dimethyl-aminomethyl-1-(3-methoxyphenyl)cyclohexanol and its salts CHEMAGIS LTD. (IL) 1997-09-30 US claimed
EP-0778262-A2 Process for the purification of (RR-SS)-2-dimethyl-aminomethyl-1-(3-methoxyphenyl)cyclohexanol and its salts Chemagis Ltd. (IL) 1997-06-11 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 (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-20070112074-A1 Tramadol recovery process TRAM1, OPRK1, SLC6A6 ACHE 894/4885CA1 2464/4885CA2 1115/4885
US-20040204485-A1 Process of preparing esters and ethers of probucol and derivatives thereof NR3C2, MGLL, GCG ACHE 4145/4885CA1 2271/4885CA2 1983/4885

“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.