Erythro-Hydrobupropion

Erythro-Hydrobupropion

SCHEMBL3320146

C[C@@H](NC(C)(C)C)[C@H](O)c1cccc(Cl)c1

nearest known ligand 0.65

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SLC6A4 P31645 3/20 0.65
▸ SLC6A2 P23975 5/20 0.50
▸ CYP2C19 P33261 4/20 0.50
▸ SLC6A3 Q01959 3/20 0.50
▸ CHRNA1 P02708 1/20 0.50
▸ CHRNG P07510 1/20 0.50
▸ ITGA5 P08648 1/20 0.50
▸ CHRNB1 P11230 1/20 0.50
▸ CHRNB2 P17787 1/20 0.50
▸ CHRNB4 P30926 1/20 0.50
▸ CHRNA3 P32297 1/20 0.50
▸ HRH1 P35367 1/20 0.50
▸ CHRNA7 P36544 1/20 0.50
▸ OPRK1 P41145 1/20 0.50
▸ CHRNA4 P43681 1/20 0.50
▸ CHRND Q07001 1/20 0.50
▸ KCNH2 Q12809 1/20 0.50
▸ ALDH1A1 P00352 2/20 0.49
▸ BLM P54132 1/20 0.49
▸ SMN1; SMN2 Q16637 1/20 0.49

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
Erythro-Hydrobupropion SCHEMBL29465706 1.00 SLC6A4 (0.65) SLC6A4SLC6A2CYP2C19SLC6A3CHRNA1
Erythro-Hydrobupropion SCHEMBL1227545 1.00 SLC6A4 (0.65) SLC6A4SLC6A2CYP2C19SLC6A3CHRNA1
Erythro-Hydrobupropion SCHEMBL1226880 1.00 SLC6A4 (0.65) SLC6A4SLC6A2CYP2C19SLC6A3CHRNA1
Erythro-Hydrobupropion SCHEMBL30252298 1.00 SLC6A4 (0.65) SLC6A4SLC6A2CYP2C19SLC6A3CHRNA1
Erythro-Hydrobupropion SCHEMBL1226819 1.00 SLC6A4 (0.65) SLC6A4SLC6A2CYP2C19SLC6A3CHRNA1
Erythro-Hydrobupropion SCHEMBL1229064 1.00 SLC6A4 (0.65) SLC6A4SLC6A2CYP2C19SLC6A3CHRNA1
Erythro-Hydrobupropion SCHEMBL3320155 1.00 SLC6A4 (0.65) SLC6A4SLC6A2CYP2C19SLC6A3CHRNA1
Erythro-Hydrobupropion SCHEMBL3320024 1.00 SLC6A4 (0.65) SLC6A4SLC6A2CYP2C19SLC6A3CHRNA1
Erythro-Hydrobupropion SCHEMBL30252231 1.00 SLC6A4 (0.65) SLC6A4SLC6A2CYP2C19SLC6A3CHRNA1
Erythro-Hydrobupropion SCHEMBL6429272 0.98 SLC6A4 (0.63) SLC6A4SLC6A2CYP2C19SLC6A3CHRNA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120283334-A1 Treatment of Viral Infections BIOCOPEA, LTD. (GB) 2012-11-08 — — US claimed
EP-1759701-B1 Buproprion Metabolites for treating dementia and other cerebrovascular disorders SEPRACOR INC (US) 2010-12-22 — — EP claimed
EP-1259243-B2 BUPROPION METABOLITES AND METHODS OF THEIR SYNTHESIS AND USE SEPRACOR INC (US) 2010-07-21 — — EP claimed
US-20100125070-A1 Bupropion Metabolites and Methods of Their Synthesis and Use FANG KEVIN QUN 2010-05-20 — — US claimed
EP-1602369-B1 Bupropion Metabolites for treating anxiety SEPRACOR INC (US) 2010-04-07 — — EP claimed
EP-1259243-B1 BUPROPION METABOLITES AND METHODS OF THEIR SYNTHESIS AND USE SEPRACOR INC (US) 2006-06-28 — — EP claimed
EP-1602369-A2 Bupropion Metabolites and Methods of their Synthesis and Use Sepracor, Inc. (US) 2005-12-07 — — EP claimed
EP-1259243-A2 BUPROPION METABOLITES AND METHODS OF THEIR SYNTHESIS AND USE SEPRACOR, INC. (US) 2002-11-27 — — EP claimed
US-20020052341-A1 Bupropion metabolites and methods of their synthesis and use SEPRACOR INC. 2002-05-02 — — US claimed
US-6337328-B1 TREATMENT OF SEXUAL DYSFUNCTION WITH 2-(3-CHLOROPHENYL)-2-HYDROXY-3,5,5-TRIMETHYL-MORPHOLINOL, 1-(3-CHLOROPHENYL)-2-((1,1-DIMETHYLETHANOL)AMINO)-1-PROPANOL, AND SEPRACOR, INC. 2002-01-08 — — US claimed
WO-2001062257-A2 BUPROPION METABOLITES AND METHODS OF THEIR SYNTHESIS AND USE SEPRACOR INC. (US) 2001-08-30 — — WO claimed
US-20190331666-A1 METHODS FOR DRUG DISCOVERY USING STEM CELL-DERIVED SCHWANN CELLS MEMORIAL SLOAN-KETTERING CANCER CENTER (US) 2019-10-31 — — US disclosed
US-20120283334-A1 Treatment of Viral Infections BIOCOPEA, LTD. (GB) 2012-11-08 — — US disclosed
EP-1759701-B1 Buproprion Metabolites for treating dementia and other cerebrovascular disorders SEPRACOR INC (US) 2010-12-22 — — EP disclosed
EP-1259243-B2 BUPROPION METABOLITES AND METHODS OF THEIR SYNTHESIS AND USE SEPRACOR INC (US) 2010-07-21 — — EP disclosed
EP-1259243-B1 BUPROPION METABOLITES AND METHODS OF THEIR SYNTHESIS AND USE SEPRACOR INC (US) 2006-06-28 — — EP disclosed
US-20060058300-A1 Intermediates of bupropion metabolites synthesis SEPRACOR INC. 2006-03-16 — — US disclosed
EP-1602369-A2 Bupropion Metabolites and Methods of their Synthesis and Use Sepracor, Inc. (US) 2005-12-07 — — EP disclosed
US-20020052341-A1 Bupropion metabolites and methods of their synthesis and use SEPRACOR INC. 2002-05-02 — — US disclosed
US-6337328-B1 TREATMENT OF SEXUAL DYSFUNCTION WITH 2-(3-CHLOROPHENYL)-2-HYDROXY-3,5,5-TRIMETHYL-MORPHOLINOL, 1-(3-CHLOROPHENYL)-2-((1,1-DIMETHYLETHANOL)AMINO)-1-PROPANOL, AND SEPRACOR, INC. 2002-01-08 — — 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 (4 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-20020052341-A1 Bupropion metabolites and methods of their synthesis and use MAOB, MAOA, HTR5A SLC6A4 5/4885SLC6A2 6/4885CYP2C19 170/4885
US-20060058300-A1 Intermediates of bupropion metabolites synthesis MAOB, MAOA, SLC18A2 SLC6A4 5/4885SLC6A2 7/4885CYP2C19 137/4885
US-20100125070-A1 Bupropion Metabolites and Methods of Their Synthesis and Use MAOB, MAOA, HTR5A SLC6A4 5/4885SLC6A2 6/4885CYP2C19 170/4885
US-20120283334-A1 Treatment of Viral Infections ELANE, EPX, MAVS SLC6A4 2547/4885SLC6A2 2689/4885CYP2C19 1735/4885

“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.

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