SCHEMBL27713624

SCHEMBL27713624

CCCCCOC(=O)C(Cl)Cl

nearest known ligand 0.59

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.54
EPHX1 P07099 1/20 0.50
TSHR P16473 4/20 0.48
ALDH1A1 P00352 2/20 0.48
HCAR2 Q8TDS4 2/20 0.47
TP53 P04637 1/20 0.46
CYP3A4 P08684 1/20 0.46
MAPK1 P28482 1/20 0.46
RAD52 P43351 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
ATM Q13315 1/20 0.45
CA12 O43570 1/20 0.45
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
CA9 Q16790 1/20 0.45
FAAH O00519 1/20 0.44
LMNA P02545 1/20 0.44
ACHE P22303 1/20 0.44

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
SCHEMBL18252664 0.98 NAAA (0.57) NAAAEPHX1TSHRALDH1A1HCAR2
SCHEMBL1456675 0.98 NAAA (0.57) NAAAEPHX1TSHRALDH1A1HCAR2
SCHEMBL3678648 0.93 ALDH1A1 (0.56) NAAAEPHX1TSHRALDH1A1HCAR2
SCHEMBL4250591 0.86 NAAA (0.54) NAAAEPHX1TSHRALDH1A1HCAR2
SCHEMBL4254663 0.84 NAAA (0.57) NAAAEPHX1TSHRALDH1A1HCAR2
SCHEMBL7625792 0.84 NAAA (0.52) NAAAEPHX1TSHRALDH1A1HCAR2
SCHEMBL8970879 0.84 NAAA (0.52) NAAAEPHX1TSHRALDH1A1HCAR2
Hexane SCHEMBL27732141 0.84 ALDH1A1 (0.42) NAAATSHRALDH1A1ATMFAAH
SCHEMBL7557055 0.83
SCHEMBL425031 0.83 NAAA (0.60) NAAAEPHX1TSHRALDH1A1HCAR2

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 17 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109836524-A Catalyst composition, ethylene- α -olefin polymer and preparation method thereof 中国石油天然气股份有限公司 2019-06-04 CN claimed
CN-109836523-A Catalyst composition, ethylene- α -olefin polymer and preparation method thereof 中国石油天然气股份有限公司 2019-06-04 CN claimed
CN-105646757-B A kind of preparation method of cationic polymerization system and high degree of unsaturation isoolefin copolymers 中国石油化工股份有限公司 2018-04-13 CN claimed
CN-105646757-A Cationic polymerization system and preparation method of high-unsaturation-degree isoolefin copolymer 中国石油化工股份有限公司 2016-06-08 CN claimed
CN-103420836-A Purifying method of fluorine-containing low-carbon aliphatic acid BIOTALK CO LTD 2013-12-04 CN claimed
CN-102260362-B Atactic multiblock styrene polymer and preparation method thereof UNIV BEIJING CHEMICAL 2013-04-10 CN claimed
CN-102260362-A Atactic multiblock styrene polymer and preparation method thereof 2011-11-30 CN claimed
CN-109836524-B Catalyst composition, ethylene-alpha-olefin polymer and preparation method thereof 中国石油天然气股份有限公司 2022-03-29 CN disclosed
CN-112574113-A Zoledronic acid intermediate compound 鲁南制药集团股份有限公司 2021-03-30 CN disclosed
CN-109836524-A Catalyst composition, ethylene- α -olefin polymer and preparation method thereof 中国石油天然气股份有限公司 2019-06-04 CN disclosed
CN-109836523-A Catalyst composition, ethylene- α -olefin polymer and preparation method thereof 中国石油天然气股份有限公司 2019-06-04 CN disclosed
CN-105646757-B A kind of preparation method of cationic polymerization system and high degree of unsaturation isoolefin copolymers 中国石油化工股份有限公司 2018-04-13 CN disclosed
CN-105646757-A Cationic polymerization system and preparation method of high-unsaturation-degree isoolefin copolymer 中国石油化工股份有限公司 2016-06-08 CN disclosed
CN-103420825-A Synthetic method of difluoroacetate BIOTALK CO LTD 2013-12-04 CN disclosed
CN-102260362-B Atactic multiblock styrene polymer and preparation method thereof UNIV BEIJING CHEMICAL 2013-04-10 CN disclosed
CN-102260362-A Atactic multiblock styrene polymer and preparation method thereof 2011-11-30 CN disclosed
CN-101092466-A Vanadium catalytic system for copolymerization of ethylene, propylene and diene and application thereof PETROCHINA CO LTD (CN) 2007-12-26 CN disclosed