SCHEMBL10789751

SCHEMBL10789751

c1ccc(-c2ccccc2C2CCCC2)cc1

nearest known ligand 0.60

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 1/20 0.60
BRD4 O60885 1/20 0.49
CYP11B2 P19099 3/20 0.45
ADRA2A P08913 1/20 0.45
ADRA1D P25100 1/20 0.45
ADRA1A P35348 1/20 0.45
PTPN5 P54829 4/20 0.44
PTPN2 P17706 1/20 0.43
CHRNB2 P17787 1/20 0.43
CHRNA4 P43681 1/20 0.43
GAA P10253 1/20 0.42
BCHE P06276 1/20 0.41
ACHE P22303 1/20 0.41
PTGDR2 Q9Y5Y4 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41

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
SCHEMBL29433489 1.00 PTGS2 (0.60) PTGS2BRD4CYP11B2ADRA2AADRA1D
Cyclohexane SCHEMBL9787037 0.98 PTGS2 (0.63) PTGS2BRD4CYP11B2ADRA2AADRA1D
SCHEMBL28154893 0.98 PTGS2 (0.63) PTGS2BRD4CYP11B2ADRA2AADRA1D
SCHEMBL30407966 0.98 PTGS2 (0.63) PTGS2BRD4CYP11B2ADRA2AADRA1D
SCHEMBL60703 0.98 PTGS2 (0.63) PTGS2BRD4CYP11B2ADRA2AADRA1D
Benzene SCHEMBL27912155 0.98 PTGS2 (0.63) PTGS2BRD4CYP11B2ADRA2AADRA1D
Water SCHEMBL27498058 0.96 PTGS2 (0.61) PTGS2BRD4CYP11B2ADRA2AADRA1D
Phosphine SCHEMBL27888972 0.96 PTGS2 (0.61) PTGS2BRD4CYP11B2ADRA2AADRA1D
Hydrogen Sulfide SCHEMBL27800905 0.96 PTGS2 (0.61) PTGS2BRD4CYP11B2ADRA2AADRA1D
SCHEMBL28228917 0.96 PTGS2 (0.56) PTGS2BRD4CYP11B2ADRA2AADRA1D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1167680-C fused ring compound and pharmaceutical use thereof �ձ��̲ݲ�ҵ��ʽ���� 2004-09-22 CN claimed
CN-118439920-A Alkenyl-containing liquid crystal compound and preparation method and application thereof 北京八亿时空液晶科技股份有限公司 2024-08-06 CN disclosed
CN-113214083-B Self-alignment polymerizable compound and application thereof 北京八亿时空液晶科技股份有限公司 2022-04-22 CN disclosed
EP-3898237-A1 BIAXIALLY ORIENTED POLYPROPYLENE FILM WITH IMPROVED SURFACE PROPERTIES Borealis AG (AT) 2021-10-27 EP disclosed
CN-113214083-A Self-alignment polymerizable compound and application thereof 北京八亿时空液晶科技股份有限公司 2021-08-06 CN disclosed
WO-2020127862-A1 BIAXIALLY ORIENTED POLYPROPYLENE FILM WITH IMPROVED SURFACE PROPERTIES BOREALIS AG (AT) 2020-06-25 WO disclosed
CN-101811985-B Method for producing pentylcyclohexylbiphenylcarbonitrile JIANSU LIANHE CHEMICAL CO LTD 2013-09-25 CN disclosed
CN-102421843-A Method for suppressing crystal growth rate of amide compound and method for producing polyolefin-based resin molded article NEW JAPAN CHEM CO LTD 2012-04-18 CN disclosed
CN-102159638-A New sewage pipe material with improved properties BOREALIS AG 2011-08-17 CN disclosed
CN-101811985-A Method for producing pentylcyclohexylbiphenylcarbonitrile JIANGSU KANGXIANG GROUP COMPANY 2010-08-25 CN disclosed
CN-1604922-A Pressure pipe BOREALIS TECH OY (FI) 2005-04-06 CN disclosed
CN-1167680-C fused ring compound and pharmaceutical use thereof �ձ��̲ݲ�ҵ��ʽ���� 2004-09-22 CN disclosed
CN-1529723-A Propylene polymer pipes for pipelines 2004-09-15 CN disclosed
CN-1529731-A Industrial polyolefin piping system 2004-09-15 CN disclosed
CN-1529733-A Polyolefin mulfilayer pipe 2004-09-15 CN disclosed
CN-1529732-A Polyolefin coated steel pipes 2004-09-15 CN disclosed
CN-1529722-A Propylene polymer with improved properties 2004-09-15 CN disclosed
EP-0144149-B1 DIELECTRIC FLUID EXXON RESEARCH AND ENGINEERING COMPANY (US) 1987-12-09 EP disclosed
US-4613923-A 1-PHENYL-TETRAHYDRONAPHTHYL-ETHANE EXXON RESEARCH & ENGINEERING CO. (US) 1986-09-23 US disclosed
EP-0144149-A1 Dielectric fluid EXXON RESEARCH AND ENGINEERING COMPANY (US) 1985-06-12 EP disclosed