SCHEMBL570658

SCHEMBL570658

COC(c1ccccc1)(c1ccccc1)[C@H](O)C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
EDNRB P24530 15/20 0.50
EDNRA P25101 15/20 0.50
NR1I2 O75469 1/20 0.50
KCNE1 P15382 1/20 0.50
KCNQ1 P51787 1/20 0.50
POLB P06746 1/20 0.50
CES1 P23141 1/20 0.46
KCNN4 O15554 1/20 0.46
TSHR P16473 1/20 0.41
CYP1A2 P05177 1/20 0.39
CYP2D6 P10635 1/20 0.39
MAPT P10636 1/20 0.38
KMT2A Q03164 1/20 0.38

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
SCHEMBL1067633 1.00 EDNRB (0.50) EDNRBEDNRANR1I2KCNE1KCNQ1
SCHEMBL570417 1.00 EDNRB (0.50) EDNRBEDNRANR1I2KCNE1KCNQ1
SCHEMBL28079200 0.98 EDNRB (0.49) EDNRBEDNRANR1I2KCNE1KCNQ1
SCHEMBL28079191 0.98 EDNRB (0.49) EDNRBEDNRANR1I2KCNE1KCNQ1
SCHEMBL28227186 0.98 EDNRB (0.49) EDNRBEDNRANR1I2KCNE1KCNQ1
SCHEMBL28079222 0.98 EDNRB (0.49) EDNRBEDNRANR1I2KCNE1KCNQ1
Valine SCHEMBL17965930 0.87 SLC7A5 (0.44) EDNRBEDNRANR1I2KCNE1KCNQ1
SCHEMBL4436073 0.87 EDNRB (0.40) EDNRBEDNRANR1I2KCNE1KCNQ1
SCHEMBL4440829 0.87 EDNRB (0.40) EDNRBEDNRANR1I2KCNE1KCNQ1
SCHEMBL14886539 0.87 EDNRB (0.46) EDNRBEDNRANR1I2KCNE1KCNQ1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110437063-B Preparation method of ambrisentan key intermediate 常州恒邦药业有限公司 2022-04-29 CN claimed
CN-111099993-B Preparation method of (S) -2-hydroxy-3-methoxy-3, 3-diphenyl propionic acid 常州恒邦药业有限公司 2022-03-29 CN claimed
CN-108250151-B Preparation method of ambrisentan 济南周行医药科技有限公司 2021-03-16 CN claimed
CN-111099993-A Preparation method of (S) -2-hydroxy-3-methoxy-3, 3-diphenyl propionic acid 常州恒邦药业有限公司 2020-05-05 CN claimed
CN-110437063-A The preparation method of ambrisentan key intermediate JIANGSU HANSOH PHARMACEUTICAL GROUP CO LTD 2019-11-12 CN claimed
CN-103396370-B A kind of purification process of ambrisentan 浙江华海药业股份有限公司 2018-11-16 CN claimed
CN-108250151-A A kind of preparation method of ambrisentan 济南周行医药科技有限公司 2018-07-06 CN claimed
CN-104098462-B The method for splitting of the diphenyl-propionic acid racemoid of 2 hydroxyl, 3 methoxyl group 3,3 江苏豪森药业集团有限公司 2017-11-17 CN claimed
CN-103086877-B A kind of method for splitting of 2 hydracrylic acid class racemoid 浙江华海药业股份有限公司 2017-08-25 CN claimed
US-9533960-B2 Preparation process of carboxylic acid derivatives and intermediates thereof KERN PHARMA, S.L. (ES) 2017-01-03 US claimed
US-20130184490-A1 PROCESS TO PREPARE S-2-HYDROXY-3-METHOXY-3,3-DIPHENYL PROPIONIC ACID NATCO PHARMA LIMITED (IN) 2013-07-18 US claimed
US-8404840-B2 Process for the preparation of endothelin receptor antagonists MSN LABORATORIES LIMITED (IL) 2013-03-26 US claimed
US-20130060031-A1 PROCESS FOR THE PREPARATION OF HIGHLY PURE AMBRISENTAN NATCO PHARMA LIMITED (IN) 2013-03-07 US claimed
US-20120184573-A1 PROCESS FOR THE PREPARATION OF AMBRISENTAN AND NOVEL INTERMEDIATES THEREOF CADILA HEALTHCARE LIMITED (IN) 2012-07-19 US claimed
EP-2451786-A2 IMPROVED PROCESS FOR THE PREPARATION OF AMBRISENTAN AND NOVEL INTERMEDIATES THEREOF Cadila Healthcare Limited (IN) 2012-05-16 EP claimed
WO-2012017441-A1 IMPROVED PROCESS TO PREPARE S-2-HYDROXY-3-METHOXY-3,3-DIPHENYL PROPIONIC ACID NATCO PHARMA LIMITED (IN) 2012-02-09 WO claimed
US-20110263854-A1 Improved Process For The Preparation Of Endothelin Receptor Antagonists MSN LABORATORIES LIMITED (IN) 2011-10-27 US claimed
EP-2350024-A2 IMPROVED PROCESS FOR THE PREPARATION OF ENDOTHELIN RECEPTOR ANTAGONISTS MSN Laboratories Limited (IN) 2011-08-03 EP claimed
WO-2010091877-A2 PROCESS FOR PRODUCING AMBRISENTAN RATIOPHARM GMBH (DE) 2010-08-19 WO claimed
WO-2010070658-A2 IMPROVED PROCESS FOR THE PREPARATION OF ENDOTHELIN RECEPTOR ANTAGONISTS MSN LABORATORIES LIMITED (IN) 2010-06-24 WO 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 (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-20130060031-A1 PROCESS FOR THE PREPARATION OF HIGHLY PURE AMBRISENTAN AGTR2, PDE7A, ACVR1B EDNRB 4/4885EDNRA 10/4885NR1I2 3650/4885
US-20130184490-A1 PROCESS TO PREPARE S-2-HYDROXY-3-METHOXY-3,3-DIPHENYL PROPIONIC ACID PAH, TGFB2, TGFBR2 EDNRB 29/4885EDNRA 26/4885NR1I2 2862/4885
US-20110263854-A1 Improved Process For The Preparation Of Endothelin Receptor Antagonists EDNRA, EDNRB, ECE1 EDNRB 2/4885EDNRA 1/4885NR1I2 2109/4885
US-20120184573-A1 PROCESS FOR THE PREPARATION OF AMBRISENTAN AND NOVEL INTERMEDIATES THEREOF ACVR1, ACVR1B, CYP11B1 EDNRB 7/4885EDNRA 27/4885NR1I2 2689/4885

“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.