SCHEMBL282873

SCHEMBL282873

CCCCc1oc2ccc([N+](=O)[O-])cc2c1C(=O)c1ccc(O)cc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EYA3 Q99504 4/20 0.65
PTPN1 P18031 1/20 0.65
HTT P42858 2/20 0.57
LMNA P02545 1/20 0.57
SLC22A12 Q96S37 4/20 0.57
TTR P02766 1/20 0.49
CYP2C9 P11712 1/20 0.49
MAPK1 P28482 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
CA12 O43570 1/20 0.46
CA9 Q16790 1/20 0.46
NR1H4 Q96RI1 1/20 0.46
ESR1 P03372 1/20 0.44
PGR P06401 1/20 0.44
CHRM2 P08172 1/20 0.44
HTR1A P08908 1/20 0.44
ADRA2A P08913 1/20 0.44
ADORA3 P0DMS8 1/20 0.44
CHRM1 P11229 1/20 0.44

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
SCHEMBL29464057 1.00 EYA3 (0.65) EYA3PTPN1HTTLMNASLC22A12
SCHEMBL9486589 0.93 HTT (0.60) EYA3PTPN1HTTLMNASLC22A12
SCHEMBL15362406 0.91 EYA3 (0.53) EYA3PTPN1HTTLMNASLC22A12
SCHEMBL12964086 0.90 EYA3 (0.52) EYA3PTPN1HTTLMNASLC22A12
SCHEMBL446008 0.90 EYA3 (0.52) EYA3PTPN1HTTLMNASLC22A12
SCHEMBL4891172 0.90 EYA3 (0.57) EYA3PTPN1HTTLMNATTR
SCHEMBL12074785 0.89 EYA3 (0.51) EYA3PTPN1HTTLMNASLC22A12
SCHEMBL5711188 0.89 SLC22A12 (0.73) EYA3PTPN1HTTLMNASLC22A12
SCHEMBL4567254 0.89 KDM5A (0.58) ESR1PGRCHRM2HTR1AADRA2A
SCHEMBL283212 0.89 MAPK1 (0.60) EYA3PTPN1HTTSLC22A12CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115385880-A Industrial preparation method of environment-friendly dronedarone key intermediate 南京方生和医药科技有限公司 2022-11-25 CN claimed
CN-109970693-A A kind of preparation method of dronedarone key intermediate 南京方生和医药科技有限公司 2019-07-05 CN claimed
CN-105753822-B A kind of benzofuran derivative, its preparation method and application 华润赛科药业有限责任公司 2018-04-03 CN claimed
CN-106892886-A A kind of preparation method of dronedarone hydrochloride 上海华源医药科技发展有限公司 2017-06-27 CN claimed
CN-105753822-A Benzofuran derivative and preparation method and application thereof 华润赛科药业有限责任公司 2016-07-13 CN claimed
EP-2417099-B1 NEW PROCESS FOR PREPARING HYDROXYLAMINES AND MEDICAMENTS CAMBREX KARLSKOGA AB (SE) 2015-12-23 EP claimed
CN-102459154-B For the preparation of the novel method of azanol class and medicine CAMBREX KARLSKOGA AB (SE) 2015-12-02 CN claimed
EP-2388256-B1 Process for preparing benzofurans CAMBREX KARLSKOGA AB (SE) 2015-11-25 EP claimed
CN-105061369-A Related substance F of dronedarone hydrochloride and preparation method for related substance F NANJING CHIA TAI TIANQING PHARMACEUTICAL CO LTD 2015-11-18 CN claimed
CN-102171200-B For the preparation of the method for diones and medicine CAMBREX KARLSKOGA AB (SE) 2015-09-30 CN claimed
CN-102171200-A New process for preparing diketones and medicaments CAMBREX KARLSKOGA AB 2011-08-31 CN claimed
CN-102153530-A Novel method for synthesizing dronedarone key intermediate BEIJING ORGGREEN CHEMISTRY TECHNOLOGY CO LTD 2011-08-17 CN claimed
EP-2356100-A1 NEW PROCESS FOR PREPARING DIKETONES AND MEDICAMENTS Cambrex Karlskoga AB (SE) 2011-08-17 EP claimed
CN-101948455-A Preparation method of 2-n-butyl-3-(4-hydroxybenzoyl)-5-nitrobenzofuran SHANDONG ZOUPING DAZHAN NEW MATERIAL CO LTD 2011-01-19 CN claimed
US-20100292319-A1 PROCESS FOR PREPARING BENZOFURANS CAMBREX KARLSKOGA AB (SE) 2010-11-18 US claimed
WO-2010116140-A1 NEW PROCESS FOR PREPARING HYDROXYLAMINES AND MEDICAMENTS CAMBREX KARLSKOGA AB (SE) 2010-10-14 WO claimed
CN-101861308-A Process for the preparation of benzofuran compounds CAMBREX KARLSKOGA AB 2010-10-13 CN claimed
EP-2200993-A2 PROCESS FOR PREPARING BENZOFURANS Cambrex Karlskoga AB (SE) 2010-06-30 EP claimed
WO-2010038029-A1 NEW PROCESS FOR PREPARING DIKETONES AND MEDICAMENTS CAMBREX KARLSKOGA AB (SE) 2010-04-08 WO claimed
WO-2009044143-A2 PROCESS FOR PREPARING BENZOFURANS CAMBREX KARLSKOGA AB (SE) 2009-04-09 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 (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-20100292319-A1 PROCESS FOR PREPARING BENZOFURANS CYP2F1, CYP3A4, CYP4F3 EYA3 4548/4885PTPN1 4513/4885HTT 2787/4885

“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.