SCHEMBL227588

SCHEMBL227588

OCc1ccc(OCCN2CCCCCC2)cc1

nearest known ligand 0.85

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 6/20 0.85
PSMB1 P20618 6/20 0.76
PSMB5 P28074 6/20 0.76
PSMB2 P49721 6/20 0.76
LTA4H P09960 7/20 0.68
ESR1 P03372 1/20 0.63
ESR2 Q92731 1/20 0.63

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
SCHEMBL224627 1.00 HRH3 (0.85) HRH3PSMB1PSMB5PSMB2LTA4H
SCHEMBL8973201 0.98 HRH3 (0.82) HRH3PSMB1PSMB5PSMB2LTA4H
Hydroxyamine SCHEMBL6816656 0.97 HRH3 (0.80) HRH3PSMB1PSMB5PSMB2LTA4H
SCHEMBL4089206 0.92 HRH3 (1.00) HRH3
SCHEMBL6657187 0.87 HRH3 (0.86) HRH3PSMB1PSMB5PSMB2LTA4H
SCHEMBL12128339 0.87 HRH3 (0.85) HRH3
SCHEMBL17826374 0.87 PSMB1 (0.71) HRH3PSMB1PSMB5PSMB2LTA4H
SCHEMBL9056254 0.85 HRH3 (0.83) HRH3PSMB1PSMB5PSMB2LTA4H
SCHEMBL30777699 0.85 HRH3 (1.00) HRH3PSMB1PSMB5PSMB2LTA4H
SCHEMBL3580727 0.85 HRH3 (1.00) HRH3PSMB1PSMB5PSMB2LTA4H

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107793344-B Industrial production method of bazedoxifene acetate 扬子江药业集团有限公司 2021-01-12 CN claimed
CN-107793344-B Industrial production method of bazedoxifene acetate 扬子江药业集团有限公司 2021-01-12 CN disclosed
US-9751835-B2 Processes and intermediates for preparing indole pharmaceuticals INDIANA UNIVERSITY RESEARCH AND TECHNOLOGY CORPORATION (US) 2017-09-05 US disclosed
US-9751835-B2 Processes and intermediates for preparing indole pharmaceuticals INDIANA UNIVERSITY RESEARCH AND TECHNOLOGY CORPORATION (US) 2017-09-05 US disclosed
US-20160107991-A1 PROCESSES AND INTERMEDIATES FOR PREPARING INDOLE PHARMACEUTICALS INDIANA UNIVERSITY RESEARCH AND TECHNOLOGY CORPORATION 2016-04-21 US disclosed
US-20160107991-A1 PROCESSES AND INTERMEDIATES FOR PREPARING INDOLE PHARMACEUTICALS INDIANA UNIVERSITY RESEARCH AND TECHNOLOGY CORPORATION 2016-04-21 US disclosed
WO-2014186325-A1 PROCESSES AND INTERMEDIATES FOR PREPARING INDOLE PHARMACEUTICALS INDIANA UNIVERSITY RESEARCH AND TECHNOLOGY CORPORATION (US) 2014-11-20 WO disclosed
EP-1577288-B1 Selective estrogen receptor modulators EISAI R&D MAN CO LTD (JP) 2014-07-23 EP disclosed
US-8399520-B2 Selective estrogen receptor modulator EISAI R&D MANAGEMENT CO., LTD. (JP) 2013-03-19 US disclosed
WO-2012079154-A1 SELECTIVE ESTROGEN RECEPTOR MODULATORS DALHOUSIE UNIVERSITY (CA) 2012-06-21 WO disclosed
US-20080207898-A1 PROCESSES FOR THE PREPARATION OF AMINOETHOXYBENZYL ALCOHOLS WYETH (US) 2008-08-28 US disclosed
US-20080207898-A1 PROCESSES FOR THE PREPARATION OF AMINOETHOXYBENZYL ALCOHOLS WYETH (US) 2008-08-28 US disclosed
US-7375251-B2 Processes for the preparation of aminoethoxybenzyl alcohols WYETH (US) 2008-05-20 US disclosed
US-7375251-B2 Processes for the preparation of aminoethoxybenzyl alcohols WYETH (US) 2008-05-20 US disclosed
US-7375251-B2 Processes for the preparation of aminoethoxybenzyl alcohols WYETH (US) 2008-05-20 US disclosed
EP-1836155-A2 PROCESSES FOR THE PREPARATION OF AMINOETHOXYBENZYL ALCOHOLS Wyeth, A Corporation of the State of Delaware (US) 2007-09-26 EP disclosed
WO-2006076350-A2 PROCESSES FOR THE PREPARATION OF AMINOETHOXYBENZYL ALCOHOLS WYETH (US) 2006-07-20 WO disclosed
US-20060155147-A1 Processes for the preparation of aminoethoxybenzyl alcohols WYETH (US) 2006-07-13 US disclosed
US-20060116364-A1 Such as (R)-6-{2-{ethyl[4-(2-ethylaminoethyl)benzyl]amino }-4-methoxyphenyl }-5,6,7,8-tetrahydronaphthalen-2-ol; osteoporosis; breast cancer EISAI CO., LTD. (JP) 2006-06-01 US disclosed
EP-1577288-A1 SELECTIVE ESTROGEN RECEPTOR MODULATORS Eisai Co., Ltd. (JP) 2005-09-21 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 (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-20080207898-A1 PROCESSES FOR THE PREPARATION OF AMINOETHOXYBENZYL ALCOHOLS ADH1A, ADH1C, ADH5 HRH3 1480/4885PSMB1 2032/4885PSMB5 1992/4885
US-20060155147-A1 Processes for the preparation of aminoethoxybenzyl alcohols ADH1A, ADH1C, ADH5 HRH3 1480/4885PSMB1 2032/4885PSMB5 1992/4885
US-20060116364-A1 Such as (R)-6-{2-{ethyl[4-(2-ethylaminoethyl)benzyl]amino }-4-methoxyphenyl }-5,6,7,8-tetrahydronaphthalen-2-ol; osteoporosis; breast cancer BRCA1, BCR, RCC1 HRH3 114/4885PSMB1 1323/4885PSMB5 1564/4885
US-20160107991-A1 PROCESSES AND INTERMEDIATES FOR PREPARING INDOLE PHARMACEUTICALS CYP19A1, IDO1, IDO2 HRH3 1724/4885PSMB1 2543/4885PSMB5 1225/4885

“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.