SCHEMBL5085704

SCHEMBL5085704

CCC(C)CC(c1ccccc1)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 4/20 0.48
CHRM2 P08172 2/20 0.48
CHRM1 P11229 2/20 0.48
ADRA1A P35348 2/20 0.48
SLC6A3 Q01959 2/20 0.48
KCNH2 Q12809 2/20 0.48
CACNA1F O60840 1/20 0.48
ADRA2B P18089 1/20 0.48
CHRM3 P20309 1/20 0.48
OPRK1 P41145 1/20 0.48
CACNA1D Q01668 1/20 0.48
CACNA1S Q13698 1/20 0.48
CACNA1C Q13936 1/20 0.48
SCN5A Q14524 1/20 0.48
LMNA P02545 3/20 0.48
TRPA1 O75762 4/20 0.47
FFAR1 O14842 1/20 0.44
TAAR1 Q96RJ0 4/20 0.43
HTR2A P28223 4/20 0.43
TDP1 Q9NUW8 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
SCHEMBL27540029 0.98 HRH1 (0.47) HRH1CHRM2CHRM1ADRA1ASLC6A3
SCHEMBL9490631 0.84 TRPA1 (0.67) LMNATRPA1FFAR1TAAR1POLB
SCHEMBL8602760 0.84 SLC6A3 (0.41) HRH1CHRM2CHRM1ADRA1ASLC6A3
SCHEMBL22305164 0.82 TRPA1 (0.50) HRH1CHRM2CHRM1ADRA1ASLC6A3
SCHEMBL18133515 0.81 FFAR1 (0.36) HRH1CHRM2CHRM1ADRA1ASLC6A3
SCHEMBL18297776 0.80 ESR1 (0.54) CHRM2CHRM1ADRA1ASLC6A3LMNA
SCHEMBL1901307 0.80 LMNA (0.43) HRH1CHRM2CHRM1ADRA1ASLC6A3
SCHEMBL29308038 0.80 LMNA (0.43) HRH1CHRM2CHRM1ADRA1ASLC6A3
SCHEMBL477347 0.80 LMNA (0.65) LMNATRPA1ADRA2A
SCHEMBL11996616 0.80 NPSR1 (0.38) LMNAMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2004715-A2 METHOD TO PREPARE BLOCK COPOLYMERS BY THE COMBINATION OF CATIONIC AND ANIONIC POLYMERIZATION UNIVERSITY OF MASSACHUSETTS LOWELL (US) 2008-12-24 EP claimed
WO-2007117566-A2 METHOD TO PREPARE BLOCK COPOLYMERS BY THE COMBINATION OF CATIONIC AND ANIONIC POLYMERIZATION UNIVERSITY OF MASSACHUSETTS LOWELL (US) 2007-10-18 WO claimed
CN-110114377-B Novel compositions and methods for block copolymer self-assembly 默克专利有限公司 2022-06-03 CN disclosed
CN-110461957-A INK AND INK SET DAINIPPON INK & CHEMICALS 2019-11-15 CN disclosed
CN-103365081-B Coloured composition, colored filter, display element and dispersible pigment dispersion JSR株式会社 2018-06-15 CN disclosed
CN-105051083-B (Methyl)Acrylic block copolymer and its manufacture method 株式会社可乐丽 2018-05-15 CN disclosed
CN-106574029-A Active energy ray-curable composition 株式会社可乐丽 2017-04-19 CN disclosed
CN-105612226-A Aqueous pigment dispersion and aqueous ink for inkjet recording use DAINIPPON INK & CHEMICALS 2016-05-25 CN disclosed
CN-105593257-A Aqueous pigment dispersion, pigment dispersant, and core-shell polymer particle DAINIPPON INK & CHEMICALS 2016-05-18 CN disclosed
CN-103365081-A Colored composition, color filter, display element and pigment dispersion liquid JSR CORP 2013-10-23 CN disclosed
EP-2004715-A2 METHOD TO PREPARE BLOCK COPOLYMERS BY THE COMBINATION OF CATIONIC AND ANIONIC POLYMERIZATION UNIVERSITY OF MASSACHUSETTS LOWELL (US) 2008-12-24 EP disclosed
US-20030204033-A1 Process for polymerizing a methacrylic ester or an acrylic ester KURARAY CO., LTD. (JP) 2003-10-30 US disclosed
US-6630554-B1 Methacrylic ester or an acrylic ester is anionically polymerized, using a polymerization initiator compound omprising an addition reaction product of a conjugated diene compound and an organic alkali metal compound, in the presence KURARAY CO., LTD. (JP) 2003-10-07 US disclosed
US-6217643-B1 A COLOR FORMER COMPOSED OF A MIXTURE OF THE COLOR FORMERS 3-DIETHYLAMINO-6-METHYL-7-(2',4'-DIMETHYLANILINO)FLUORAN AND 3-DIBUTYLAMINO-6-METHYL-7-ANILINOFLUORAN OR MIXTURE ESCO COMPANY 2001-04-17 US disclosed
EP-1085029-A1 Process for polymerizing a methacrylic ester or an acrylic ester KURARAY CO., LTD. (JP) 2001-03-21 EP disclosed
EP-0753255-B1 Pesticidal compositions comprising diarylalkanes NIPPON PETROCHEMICALS CO LTD (JP) 2000-12-20 EP disclosed
US-5866514-A HIGH BOILING; ODORLESS; ANTISEPTICS, HERBICIES, INSECTICIDES NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1999-02-02 US disclosed
EP-0753255-A2 Pesticidal compositions comprising diarylalkanes NIPPON PETROCHEMICALS CO., LTD. (JP) 1997-01-15 EP disclosed
US-5180799-A Organolithium-Organoaluminum Catalyst IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1993-01-19 US disclosed
EP-0434316-A1 Processes ZENECA LIMITED (GB) 1991-06-26 EP disclosed