SCHEMBL28087459

SCHEMBL28087459

NCc1[c]c(CN)ccc1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LOXL2 Q9Y4K0 4/20 0.43
HRH3 Q9Y5N1 1/20 0.36
TAAR1 Q96RJ0 1/20 0.36
PNMT P11086 3/20 0.35
ABAT P80404 1/20 0.33
ENPP2 Q13822 1/20 0.33
ADRB2 P07550 1/20 0.31
LTA4H P09960 1/20 0.30
CYP2E1 P05181 1/20 0.30
CYP3A4 P08684 1/20 0.30
CYP2A6 P11509 1/20 0.30
CYP2C9 P11712 1/20 0.30
CYP2B6 P20813 1/20 0.30
CYP2C19 P33261 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
SCHEMBL18706209 0.77 TAAR1 (0.32) LOXL2TAAR1CYP3A4
SCHEMBL28814181 0.72 NPC1 (0.33)
SCHEMBL65919 0.69
SCHEMBL11612858 0.69 TRPA1 (0.36)
SCHEMBL18632228 0.69
SCHEMBL10463113 0.69 TSHR (0.36) ENPP2
SCHEMBL177278 0.69 GABRA1 (0.38)
SCHEMBL6897074 0.68 LOXL2 (0.37) LOXL2TAAR1CYP2A6
SCHEMBL8382605 0.67
SCHEMBL8729522 0.66

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108686706-A Ethylene selective oligomerization method and catalyst 中国石油天然气股份有限公司 2018-10-23 CN claimed
CN-105541548-B The preparation method of methanol and glycol 神华集团有限责任公司 2018-05-25 CN claimed
CN-107964668-A C (sp in compound3)-H keys are converted into C (sp3)-O keys method and the compound that is prepared 中国科学院上海有机化学研究所 2018-04-27 CN claimed
CN-105153643-B A kind of compositions of thermosetting resin and application thereof 东莞东超新材料科技有限公司 2018-02-02 CN claimed
CN-106632940-A Polycarbodiimide compounds, preparation method thereof and liquid type hydrolysis-resistant agent composition 上海华峰新材料研发科技有限公司 2017-05-10 CN claimed
CN-106083927-A Phosphinyl amidine compound, metal complex, antigravity system and their oligomeric or purposes of olefin polymerization 切弗朗菲利浦化学公司 2016-11-09 CN claimed
CN-110366449-A Catalyst for hydrosilylation, hydrogenation, and hydrosilane reduction 国立大学法人九州大学 2019-10-22 CN disclosed
CN-110325510-A High stability lubricating oil base stock and method for making same 埃克森美孚化学专利公司 2019-10-11 CN disclosed
CN-105745231-B Method for producing polymers from pyridyldiamido transition metal complexes and use thereof 埃克森美孚化学专利公司 2019-09-13 CN disclosed
CN-110183495-A Electroluminescent organic material and device 环球展览公司 2019-08-30 CN disclosed
CN-110099884-A Ethylene oligomerisation processes 切弗朗菲利浦化学公司 2019-08-06 CN disclosed
CN-104941682-B Catalyst composition and for making ethylene oligomerization at the method for 1- hexene IFP 新能源公司 2019-07-30 CN disclosed
CN-109937217-A The bull or double end composition that are moved suitable for chain shuttle and preparation method 陶氏环球技术有限责任公司 2019-06-25 CN disclosed
CN-107236272-A A kind of thin-walled anti-static halogen-free flame-retardant PC/ABS compositions and preparation method thereof 广东圆融新材料有限公司 2017-10-10 CN disclosed
CN-105085815-B alpha-olefin-dicyclopentadiene copolymer and preparation method thereof 中国石油天然气股份有限公司 2017-08-04 CN disclosed
CN-103732606-B New cyclopentano [B] fluorenyl transition metal compound, the carbon monoxide-olefin polymeric comprising it and the method using its copolymer for preparing Alathon or ethene and alhpa olefin 沙特基础工业爱思开NEXLENE私人有限公司 2017-06-09 CN disclosed
CN-106687468-A Metal complex comprising amidine and substituted cyclopentadienyl ligands 阿朗新科荷兰有限公司 2017-05-17 CN disclosed
CN-106478847-A A kind of non-metallocene rare earth metal olefin polymerization catalyst and its preparation method and application 南开大学 2017-03-08 CN disclosed
CN-103459405-B Process for producing transition metal complex, catalyst for trimerization, process for producing 1-hexene, process for producing substituted cyclopentadiene compound (1) 住友化学株式会社 2016-09-28 CN disclosed
CN-104204000-B For the method preparing high-cis polydiene 株式会社普利司通 2016-08-24 CN disclosed