SCHEMBL2451027

SCHEMBL2451027

O=C(CBr)c1cc(OCc2ccccc2)cc(OCc2ccccc2)c1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.71
KMT2A Q03164 1/20 0.71
NR4A2 P43354 3/20 0.58
MAOB P27338 2/20 0.55
NR4A1 P22736 1/20 0.54
NR4A3 Q92570 1/20 0.54
PTPN1 P18031 3/20 0.54
SMPD1 P17405 1/20 0.52
GSK3B P49841 1/20 0.52
PARP10 Q53GL7 1/20 0.51
SRD5A2 P31213 2/20 0.51
EGFR P00533 2/20 0.50
GCK P35557 1/20 0.50
PLA2G4B P0C869 1/20 0.48
LMNA P02545 1/20 0.47
CYP1A2 P05177 1/20 0.47
PTGS1 P23219 1/20 0.47
SLC6A2 P23975 1/20 0.47
CYP2C19 P33261 1/20 0.47
PTGS2 P35354 1/20 0.47

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
SCHEMBL9967899 0.90 MEN1 (0.57) MEN1KMT2ANR4A2MAOBNR4A1
SCHEMBL11122232 0.88 KMT2A (0.56) MEN1KMT2ANR4A2MAOBNR4A1
SCHEMBL1438839 0.88 NR4A2 (0.72) MEN1KMT2ANR4A2MAOBPTPN1
SCHEMBL41220 0.85 NR4A1 (0.70) NR4A2MAOBNR4A1NR4A3PTPN1
SCHEMBL11262742 0.85 MAPT (0.54) MEN1KMT2ANR4A2MAOBPTPN1
SCHEMBL13427458 0.84 MEN1 (0.71) MEN1KMT2ANR4A2MAOBNR4A1
SCHEMBL10770964 0.84 MEN1 (0.71) MEN1KMT2ANR4A2MAOBNR4A1
SCHEMBL1426961 0.83 MEN1 (1.00) MEN1KMT2ANR4A2MAOBNR4A1
SCHEMBL7107834 0.82 AR (0.57) MEN1KMT2ANR4A2MAOBPTPN1
Hydrochloric Acid SCHEMBL6841086 0.81 MEN1 (0.96) MEN1KMT2ANR4A2MAOBNR4A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240190807-A1 A METHOD FOR PREPARING R-TERBUTALINE USING CHIRAL AUXILIARY GROUPS SUZHOU HOMESUN PHARMACEUTICAL CO, LTD. (CN) 2024-06-13 US claimed
EP-4332085-A1 METHOD FOR PREPARING L-TERBUTALINE BY USING CHIRAL AUXILIARY GROUP Suzhou Homesun Pharmaceutical Co, Ltd (CN) 2024-03-06 EP claimed
CN-113264839-B Method for preparing levo-terbutaline by using chiral prosthetic group 苏州弘森药业股份有限公司 2022-08-30 CN claimed
CN-110950765-B Preparation method of terbutaline sulfate 浙江医药高等专科学校 2022-07-12 CN claimed
CN-113264839-A Method for preparing levo-terbutaline by using chiral prosthetic group 苏州弘森药业股份有限公司 2021-08-17 CN claimed
CN-112250586-A Preparation method of terbutaline sulfate and B crystal form thereof 福安药业集团宁波天衡制药有限公司 2021-01-22 CN claimed
CN-110950765-A Preparation method of terbutaline sulfate 浙江医药高等专科学校 2020-04-03 CN claimed
US-20240190807-A1 A METHOD FOR PREPARING R-TERBUTALINE USING CHIRAL AUXILIARY GROUPS SUZHOU HOMESUN PHARMACEUTICAL CO, LTD. (CN) 2024-06-13 US disclosed
US-20240190807-A1 A METHOD FOR PREPARING R-TERBUTALINE USING CHIRAL AUXILIARY GROUPS SUZHOU HOMESUN PHARMACEUTICAL CO, LTD. (CN) 2024-06-13 US disclosed
EP-4332085-A1 METHOD FOR PREPARING L-TERBUTALINE BY USING CHIRAL AUXILIARY GROUP Suzhou Homesun Pharmaceutical Co, Ltd (CN) 2024-03-06 EP disclosed
EP-4332085-A1 METHOD FOR PREPARING L-TERBUTALINE BY USING CHIRAL AUXILIARY GROUP Suzhou Homesun Pharmaceutical Co, Ltd (CN) 2024-03-06 EP disclosed
CN-110734382-B Method for synthesizing terbutaline 苏州弘森药业股份有限公司 2024-02-20 CN disclosed
CN-113995738-B Application of 2' -halogenated chalcone derivative in preparation of medicine for treating liver related diseases 中国医学科学院药物研究所 2024-02-06 CN disclosed
EP-0303465-A2 Phenethanolamine derivatives GLAXO GROUP LIMITED (GB) 1989-02-15 EP disclosed
EP-0223410-A2 Ethanolamine Derivatives GLAXO GROUP LIMITED (GB) 1987-05-27 EP disclosed
EP-0162576-A1 Ethanolamine compounds GLAXO GROUP LIMITED (GB) 1985-11-27 EP disclosed
US-4470997-A Esters IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1984-09-11 US disclosed
US-4423070-A DI- AND TRIESTERS OF N-(ACYLAMINOALKYL)-DIHYDROXYPHENYLETHANOLAMINES, ANTIINFLAMMATORY IMPERIAL CHEMICAL INDUSTRIES LIMITED (GB) 1983-12-27 US disclosed
US-4021485-A BRONCHOSPASMOLYTICS, ANTIPRURITICS, ANTIALLERGICS BOEHRINGER INGELHEIM GMBH (DT) 1977-05-03 US disclosed
US-3966814-A PERIPHERAL VASODILATORS, ANTIHISTAMINES, SPASMOLYTICS BOEHRINGER INGELHEIM GMBH (DT) 1976-06-29 US 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 (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-20240190807-A1 A METHOD FOR PREPARING R-TERBUTALINE USING CHIRAL AUXILIARY GROUPS HBB, TERT, ADRB2 MEN1 3119/4885KMT2A 2865/4885NR4A2 3541/4885

“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.