SCHEMBL843029

SCHEMBL843029

C[Si](C)(N)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.44
ESR2 Q92731 1/20 0.44
NR1H2 P55055 2/20 0.35
NR1H3 Q13133 2/20 0.35
TSHR P16473 2/20 0.35
LMNA P02545 1/20 0.35
ALOX12 P18054 1/20 0.35
ACHE P22303 1/20 0.35
SLC6A2 P23975 2/20 0.35
TAAR1 Q96RJ0 2/20 0.35
MAOA P21397 1/20 0.35
SLC6A4 P31645 1/20 0.35
SLC6A3 Q01959 1/20 0.35
SIGMAR1 Q99720 1/20 0.35
CYP2A6 P11509 1/20 0.35
ADORA2A P29274 1/20 0.35
ADORA1 P30542 1/20 0.35
MAPT P10636 1/20 0.34
BRD4 O60885 1/20 0.32
TDO2 P48775 1/20 0.32

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
SCHEMBL6858049 0.81 ESR1 (0.44) ESR1ESR2NR1H2NR1H3TSHR
SCHEMBL8194001 0.77 ESR1 (0.41) ESR1ESR2NR1H2NR1H3TSHR
SCHEMBL1494255 0.75 ESR1 (0.44) ESR1ESR2NR1H2NR1H3TSHR
SCHEMBL5607685 0.75 ESR1 (0.44) ESR1ESR2NR1H2NR1H3TSHR
SCHEMBL17444452 0.75 MEN1 (0.50) ESR1ESR2TSHRLMNAMAOA
SCHEMBL49539 0.73 TSHR (0.39) ESR1ESR2TSHRLMNAACHE
SCHEMBL7877395 0.73 TSHR (0.47) ESR1ESR2TSHRLMNAACHE
SCHEMBL3900193 0.73 TSHR (0.39) ESR1ESR2TSHRLMNAACHE
SCHEMBL2169977 0.73 ESR1 (0.48) ESR1ESR2NR1H2NR1H3TSHR
SCHEMBL239179 0.73 ESR1 (0.48) ESR1ESR2NR1H2NR1H3TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117106483-A Residual oil hydrogenation anti-coking scale inhibitor and preparation method thereof 江苏创新石化有限公司 2023-11-24 CN claimed
CN-117106483-A Residual oil hydrogenation anti-coking scale inhibitor and preparation method thereof 江苏创新石化有限公司 2023-11-24 CN disclosed
CN-113603604-B Preparation method of tert-butyl glycinate 博石丰生命科技(南通)有限公司 2023-07-21 CN disclosed
CN-110741028-B Method for producing polymer compound 住友化学株式会社 2022-05-03 CN disclosed
EP-3442045-B1 ORGANIC PHOTOELECTRIC CONVERSION ELEMENT, AND SOLAR BATTERY MODULE AND SENSOR PROVIDED WITH SAME SUMITOMO CHEMICAL CO (JP) 2022-01-12 EP disclosed
US-11063219-B2 Organic photoelectric conversion element, and solar cell module and sensor provided with the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2021-07-13 US disclosed
US-10777746-B2 Compound and electronic device SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2020-09-15 US disclosed
EP-2145929-B1 Method for manufacturing redispersible, surface-modified silicon dioxide particles EVONIK OPERATIONS GMBH (DE) 2020-06-24 EP disclosed
CN-110741028-A Method for producing polymer compound 住友化学株式会社 2020-01-31 CN disclosed
CN-106103518-B Method for producing conjugated diene rubber 日本瑞翁株式会社 2020-01-14 CN disclosed
US-20060171872-A1 silylamine treating agent; reacting the surface silanol groups to effectively replace the hydrophilic silanol groups with hydrophobic chemical group; toners CABOT CORPORATION (US) 2006-08-03 US disclosed
WO-2006045012-A2 METHOD OF PREPARING HYDROPHOBIC SILICA DIRECTLY FROM AN AQUEOUS COLLOIDAL SILICA DISPERSION CABOT CORPORATION (US) 2006-04-27 WO disclosed
EP-1571170-A1 HIGH-MOLECULAR COMPOUNDS AND POLYMER LIGHT EMITTING DEVICES MADE BY USING THE SAME Sumitomo Chemical Company, Limited (JP) 2005-09-07 EP disclosed
CN-1568332-A Metal complex compositions and their use as catalysts to produce polydienes DOW GLOBAL TECHNOLOGIES INC (US) 2005-01-19 CN disclosed
US-6737193-B2 ACTIVE MATERIALS IN THE POSITIVE ELECTRODES OF BATTERIES. NOVEL METHODS FOR PREPARING THE TETRAKETOPIPERAZINE UNIT-CONTAINING COMPOUNDS INCLUDE: (I) REACTING AN OXALYL HALIDE AND AN OXAMIDE, AND ADDING WATER OR AN AQUEOUS ALKALI IM&T RESEARCH, INC. 2004-05-18 US disclosed
US-20030148188-A1 Active materials in the positive electrodes of batteries. Novel methods for preparing the tetraketopiperazine unit-containing compounds include: (i) reacting an oxalyl halide and an oxamide, and adding water or an aqueous alkali IM&T RESEARCH, INC. 2003-08-07 US disclosed
US-6376923-B1 LIQUID EPOXY RESIN, CURING AGENT, COPOLYMER OF ALKENYL GROUP-CONTAINING EPOXY RESIN AND AN SIH GROUP-CONTAINING ORGANOPOLYSILOXANE, INORGANIC FILLER SURFACE TREATED WITH AN AMINOSILANE OR ORGANOSILAZANE SHIN-ETSU CHEMICAL CO., LTD. (JP) 2002-04-23 US disclosed
US-6130272-A FLUIDIZING REINFORCING SILICA FILLER IN HIGH-SHEAR MIXER; ADDING SILYLATING AGENT, NITROGEN COMPOUND SELECTED FROM AMMONIA, AMMONIA SALTS, NON-SILYLATED PRIMARY AMINES, AND AMINOXY COMPOUNDS, WATER; ADDING POLYDIORGANOSILOXAN; HEATING DOW CORNING CORPORATION (US) 2000-10-10 US disclosed
EP-0783021-A2 Process for making powdered base for formulating curable liquid silicone rubber composition DOW CORNING CORPORATION (US) 1997-07-09 EP disclosed
US-RE29926-E 2-Decarboxy-2-hydroxy-methyl-16-fluoro-PGE1 compounds THE UPJOHN COMPANY (US) 1979-03-06 US disclosed