SCHEMBL9863104

SCHEMBL9863104

Cc1cc(CCCCCOc2c(C(C)(C)C)cc(C3=NCCO3)cc2C(C)(C)C)on1

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.40
CYP2D6 P10635 2/20 0.40
NR1I2 O75469 1/20 0.40
SCARB1 Q8WTV0 1/20 0.33
KCNH2 Q12809 1/20 0.31
HRH3 Q9Y5N1 1/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL9862971 0.93 CYP3A4 (0.38) CYP3A4CYP2D6NR1I2SCARB1
SCHEMBL9705661 0.87 NR1I2 (0.50) CYP3A4CYP2D6NR1I2SCARB1KCNH2
SCHEMBL9862856 0.87 SCARB1 (0.39) CYP3A4CYP2D6NR1I2SCARB1KCNH2
SCHEMBL9705719 0.86 NR1I2 (0.40) CYP3A4CYP2D6NR1I2SCARB1KCNH2
SCHEMBL9705761 0.85 NR1I2 (0.39) CYP3A4CYP2D6NR1I2SCARB1KCNH2
SCHEMBL9863213 0.85 NR1I2 (0.41) CYP3A4CYP2D6NR1I2SCARB1KCNH2
SCHEMBL9705776 0.85 NR1I2 (0.39) CYP3A4CYP2D6NR1I2SCARB1KCNH2
Win-54954 SCHEMBL8755546 0.85 NR1I2 (0.39) CYP3A4CYP2D6NR1I2SCARB1KCNH2
SCHEMBL9705747 0.85 NR1I2 (0.43) CYP3A4CYP2D6NR1I2
SCHEMBL9863170 0.84 NR1I2 (0.39) CYP3A4CYP2D6NR1I2SCARB1KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3504257-A1 EPOXY RESIN COMPOSITION, PREPREG, AND FIBER REINFORCED PLASTIC MATERIAL Toray Industries, Inc. (JP) 2019-07-03 EP claimed
WO-2018037283-A1 EPOXY RESIN COMPOSITION, PREPREG, AND FIBER REINFORCED PLASTIC MATERIAL TORAY INDUSTRIES, INC. (JP) 2018-03-01 WO claimed
CN-104212663-A Detergent for washing cloth TIANJIN HANLINTEC TECHNOLOGY CO LTD 2014-12-17 CN claimed
CN-101528654-B A process for preparing polybrominated compounds BROMINE COMPOUNDS LTD 2012-12-26 CN claimed
CN-101768286-B Method for separating polybrominated diphenylether from waste electronic plastic MAOMING COLLEGE 2012-01-11 CN claimed
CN-101768286-A Method for separating polybrominated diphenylether from waste electronic plastic MAOMING COLLEGE 2010-07-07 CN claimed
CN-101528654-A A process for preparing polybrominated compounds BROMINE COMPOUNDS LTD (IL) 2009-09-09 CN claimed
CN-110172215-A A kind of low combustion heat value polyvinyl chloride composite materials and preparation method thereof 浙江亚厦装饰股份有限公司 2019-08-27 CN disclosed
CN-110037430-A A kind of solid silica gel powder puff and preparation method thereof 东莞市思创化妆品有限公司 2019-07-23 CN disclosed
CN-109749436-A It is a kind of for making the high-temperature nylon plastic and preparation method thereof of alloy chopsticks 上海普利特伴泰材料科技有限公司 2019-05-14 CN disclosed
CN-107603128-B A kind of nonmetallic composite Nano heat sink material and preparation method thereof 四川依菲兰科技有限公司 2019-03-26 CN disclosed
CN-208471979-U Flame-retardant pull tension breaks aluminum foil and adhesive tape 江阴邦特科技有限公司 2019-02-05 CN disclosed
CN-109054286-A A kind of Wear-resistant engineering plastic, processing method and plastic bearing 天津布瑞斯克精密橡塑有限公司 2018-12-21 CN disclosed
CN-1169674-A Mild shower gel composition comprising fatty alcohol which imparts improved lathering and thickening properties PROCTER & GAMBLE (US) 1998-01-07 CN disclosed
CN-1066779-A Antimicrobial soft liquid surfactant skin cleanser PROCTER & GAMBLE (US) 1992-12-09 CN disclosed
US-5002960-A Viricides for combating picornaviruses STERLING DRUG, INC. (US) 1991-03-26 US disclosed
US-4990657-A From an aromatic halide without a phase transfer agent RHONE-POULENC CHIMIE (FR) 1991-02-05 US disclosed
US-4939267-A Viricides STERLING DRUG INC. (US) 1990-07-03 US disclosed
US-4843087-A OXAZOLINYL COMPOUNDS; RHINOVIRUSES AND PICORNAVIRUSES STERLING DRUG INC. (US) 1989-06-27 US disclosed
EP-0255794-A1 Process for preparing an aromatic acid RHONE-POULENC CHIMIE (FR) 1988-02-10 EP disclosed