SCHEMBL4579619

SCHEMBL4579619

COc1ccc(-c2ccccc2)c(OC)c1OC

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC4 P56524 1/20 0.53
HDAC2 Q92769 1/20 0.53
HDAC8 Q9BY41 1/20 0.53
PTGS2 P35354 2/20 0.50
SMN1; SMN2 Q16637 3/20 0.49
NPC1 O15118 1/20 0.49
RAB9A P51151 1/20 0.49
ERN1 O75460 1/20 0.47
ALDH1A1 P00352 2/20 0.46
POLB P06746 2/20 0.46
IDO1 P14902 1/20 0.45
TDO2 P48775 1/20 0.45
KDM4E B2RXH2 1/20 0.44
LMNA P02545 1/20 0.44
MAPT P10636 1/20 0.44
HPGD P15428 1/20 0.44
MAPK1 P28482 1/20 0.44
HTT P42858 1/20 0.44
HSD17B10 Q99714 1/20 0.44
PDE4B Q07343 2/20 0.43

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
SCHEMBL29788008 1.00 HDAC4 (0.53) HDAC4HDAC2HDAC8PTGS2SMN1; SMN2
SCHEMBL10536041 0.90 HDAC4 (0.57) HDAC4HDAC2HDAC8PTGS2SMN1; SMN2
Adamantane SCHEMBL28906651 0.89 PTGS2 (0.47) HDAC4HDAC2HDAC8PTGS2SMN1; SMN2
SCHEMBL28039230 0.89 PDE4B (0.50) SMN1; SMN2ALDH1A1POLBKDM4EMAPT
SCHEMBL4359012 0.84 IDO1 (0.55) SMN1; SMN2ERN1ALDH1A1IDO1TDO2
SCHEMBL29446789 0.84 IDO1 (0.55) SMN1; SMN2ERN1ALDH1A1IDO1TDO2
SCHEMBL3643547 0.84 NPC1 (0.54) HDAC4HDAC2HDAC8PTGS2SMN1; SMN2
SCHEMBL21609119 0.84 NPC1 (0.42) PTGS2SMN1; SMN2NPC1RAB9AALDH1A1
SCHEMBL13744810 0.84 TP53 (0.51) SMN1; SMN2NPC1RAB9AALDH1A1POLB
SCHEMBL28081752 0.84 ALOX5AP (0.48) HDAC4HDAC2HDAC8PTGS2SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101654401-B Asymmetrical biphenyl compounds, medicinal compositions containing same and application of medicinal compositions INST PHARM & TOXICOLOGY AMMS 2013-06-05 CN claimed
CN-101898959-A Biphenyl compound and preparation method and use thereof UNIV JINAN 2010-12-01 CN claimed
CN-101654401-A Asymmetrical biphenyl compounds, medicinal compositions containing same and application of medicinal compositions POISON MED INST PLA MED ACAD 2010-02-24 CN claimed
JP-1011187-A None JP disclosed
CN-113874352-A Arylamine compound and use thereof 日产化学株式会社 2021-12-31 CN disclosed
CN-108727397-A phenanthridine derivatives 潍坊医学院 2018-11-02 CN disclosed
CN-108467370-A Triazole naphthoquinones biaryl(It is miscellaneous)Ring derivatives 四川大学 2018-08-31 CN disclosed
CN-105209514-B Method for producing epoxy resin containing biphenyl skeleton DIC株式会社 2017-04-12 CN disclosed
CN-105209514-A Method for producing epoxy resin containing biphenyl skeleton DAINIPPON INK & CHEMICALS 2015-12-30 CN disclosed
CN-102875599-B Three tooth Phosphine ligands and the application in linear hydroformylation and similar reaction thereof WUHAN UNIVERSITY (CN) 2015-11-04 CN disclosed
CN-105012595-A Traditional Chinese medicine composition for treating upper respiratory tract infection, and preparation method thereof LI DONGHUA 2015-11-04 CN disclosed
CN-102875599-A Novel tridentate phosphine ligand and application of same to linear hydroformylation and similar reactions UNIV WUHAN 2013-01-16 CN disclosed
CN-101898959-A Biphenyl compound and preparation method and use thereof UNIV JINAN 2010-12-01 CN disclosed
CN-101654401-A Asymmetrical biphenyl compounds, medicinal compositions containing same and application of medicinal compositions POISON MED INST PLA MED ACAD 2010-02-24 CN disclosed
US-20080132503-A1 Inhibitors of Histone Deacetylase METHYLGENE INC. (CA) 2008-06-05 US disclosed
CN-1177909-C Substituted poly (arylenevinylenes), method for the production thereof and use thereof in electroluminescent elements 2004-12-01 CN disclosed
CN-1147298-C Prevention and curing agent for c attenuation living vaccine 卫材株式会社 2004-04-28 CN disclosed
CN-1280607-A Substituted poly (arylene vinglenes), method for producing the same, and their use in electroluminescent elements AKSIWA CO LTD (DE) 2001-01-17 CN disclosed
CN-1137895-A Prevention and curing agent for c attenuation living vaccine EISAI CO LTD (JP) 1996-12-18 CN disclosed
JP-S6411187-A ANTIOXIDANT NIPPON KAYAKU KK 1989-01-13 JP 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-20080132503-A1 Inhibitors of Histone Deacetylase HDAC1, HDAC5, HDAC3 HDAC4 8/4885HDAC2 5/4885HDAC8 9/4885

“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.