SCHEMBL8439665

SCHEMBL8439665

CCCCC(C)CO[PH](=O)OCC(C)CCCC

nearest known ligand 0.35

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
CYP3A4 P08684 2/20 0.34
ACE2 Q9BYF1 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
PLA2G2C Q5R387 1/20 0.32
ATM Q13315 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
CA2 P00918 2/20 0.31
CA1 P00915 1/20 0.31
TRPM8 Q7Z2W7 5/20 0.31
FDPS P14324 1/20 0.31
DNM1 Q05193 2/20 0.31
MAPK1 P28482 1/20 0.30
OPRM1 P35372 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
SCHEMBL29768825 0.98 TSHR (0.34) TSHRSMN1; SMN2CYP3A4ACE2L3MBTL1
SCHEMBL9327746 0.94 ACE2 (0.41) ACE2CA1TRPM8FDPSOPRM1
SCHEMBL8436443 0.92 ACE2 (0.44) ACE2CA1TRPM8FDPSOPRM1
SCHEMBL15053547 0.92 ACE2 (0.44) ACE2CA1TRPM8FDPSOPRM1
SCHEMBL5090016 0.86 TSHR (0.39) TSHRCA2CA1
SCHEMBL8434330 0.83 CA2 (0.37) TSHRCYP3A4ACE2L3MBTL1PLA2G2C
SCHEMBL9326349 0.83 LMNA (0.48) CYP3A4
SCHEMBL28512180 0.82 CA2 (0.32) CYP3A4ACE2L3MBTL1CA2CA1
SCHEMBL28512178 0.82 CA2 (0.36) TSHRCYP3A4ACE2L3MBTL1PLA2G2C
SCHEMBL9637513 0.80 CYP3A4 (0.44) TSHRSMN1; SMN2CYP3A4L3MBTL1ATM

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
CN-115246913-B Stereoblock polyisoprene and preparation method thereof 中国石油化工股份有限公司 2023-10-10 CN claimed
CN-115246899-B Stereoblock polybutadiene and preparation method thereof 中国石油化工股份有限公司 2023-10-10 CN claimed
CN-115246913-A Stereoblock polyisoprene and preparation method thereof 中国石油化工股份有限公司 2022-10-28 CN claimed
CN-115246899-A Stereoblock polybutadiene and preparation method thereof 中国石油化工股份有限公司 2022-10-28 CN claimed
CN-114957526-B Stereoblock poly conjugated diene and preparation method thereof 中国石油化工股份有限公司 2024-03-26 CN disclosed
CN-115246899-B Stereoblock polybutadiene and preparation method thereof 中国石油化工股份有限公司 2023-10-10 CN disclosed
CN-115246913-B Stereoblock polyisoprene and preparation method thereof 中国石油化工股份有限公司 2023-10-10 CN disclosed
CN-112442151-B Catalytic copolymerization for preparing poly (butadiene-isoprene) 中国石油化工股份有限公司 2023-07-21 CN disclosed
CN-112409520-B Preparation of polybutadiene and catalyst thereof by homogeneous rare earth catalyst 中国石油化工股份有限公司 2023-07-21 CN disclosed
CN-112409539-B Butadiene-isoprene copolymer and preparation method thereof 中国石油化工股份有限公司 2023-07-21 CN disclosed
CN-112442148-B Homogeneous rare earth catalyst and preparation method thereof, polybutadiene and preparation method thereof 中国石油化工股份有限公司 2023-07-21 CN disclosed
CN-115246899-A Stereoblock polybutadiene and preparation method thereof 中国石油化工股份有限公司 2022-10-28 CN disclosed
CN-110294822-B Butadiene-isoprene copolymer and preparation method thereof 中国石油化工股份有限公司 2021-12-31 CN disclosed
CN-107078283-B 2- [ (methoxycarbonyl) oxy ] methyl acetate as an electrolyte component 国轩高科美国研究院 2021-08-10 CN disclosed
CN-112442148-A Homogeneous rare earth catalyst and preparation method thereof, polybutadiene and preparation method thereof 中国石油化工股份有限公司 2021-03-05 CN disclosed
CN-112442151-A Preparation of poly (butadiene-isoprene) by catalytic copolymerization 中国石油化工股份有限公司 2021-03-05 CN disclosed
CN-112409539-A Butadiene-isoprene copolymer and preparation method thereof 中国石油化工股份有限公司 2021-02-26 CN disclosed
CN-112409520-A Polybutadiene prepared by homogeneous rare earth catalyst and catalyst thereof 中国石油化工股份有限公司 2021-02-26 CN disclosed
CN-110915052-A Heterocyclic sulfonyl fluoride additives for electrolyte compositions for lithium batteries 巴斯夫欧洲公司 2020-03-24 CN disclosed
US-5922654-A TWO OR MORE ORGANOMETALLIC COMPOUNDS WHERE THE METAL IS A TRANSITION METAL OR SEMIMETAL, OR ZINC; FOR EXAMPLE, ZINC DIALKYLDITHIOPHOSPHATE, OR NICKEL DIALKYLDITHIOCARBAMATE; HIGHER LOAD BEARING PROPERTIES, HIGH TEMPERATURE PERFORMANCE NSK LTD. (JP) 1999-07-13 US disclosed