SCHEMBL150474

SCHEMBL150474

c1ccc(C[Mg]Cc2ccccc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.50
CALM1 P0DP23 1/20 0.50
HPGD P15428 1/20 0.50
ALOX15 P16050 1/20 0.50
ALOX12 P18054 1/20 0.50
CASP1 P29466 1/20 0.50
HSD17B10 Q99714 1/20 0.50
TSHR P16473 4/20 0.45
IDO1 P14902 3/20 0.45
LOXL2 Q9Y4K0 2/20 0.45
TP53 P04637 1/20 0.45
TRPA1 O75762 1/20 0.45
MAOB P27338 1/20 0.43
TDP1 Q9NUW8 2/20 0.41
CYP2A6 P11509 1/20 0.41
HTR2A P28223 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
TAAR1 Q96RJ0 1/20 0.41
THRB P10828 1/20 0.39
EPHX2 P34913 1/20 0.39

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
Hydrochloric Acid SCHEMBL29262829 0.97 ALDH1A1 (0.48) ALDH1A1CALM1HPGDALOX15ALOX12
Dimethylamine SCHEMBL6906475 0.89 KDM4E (0.48) ALDH1A1CALM1HPGDALOX15ALOX12
Dioxane SCHEMBL7176882 0.84 LMNA (0.41) ALDH1A1CALM1HPGDALOX15ALOX12
SCHEMBL3955494 0.83 TSHR (0.50) ALDH1A1CALM1HPGDALOX15ALOX12
SCHEMBL5139750 0.83 TP53 (0.50) ALDH1A1CALM1HPGDALOX15ALOX12
Hydrochloric Acid SCHEMBL28058678 0.81 TP53 (0.48) ALDH1A1CALM1HPGDALOX15ALOX12
SCHEMBL7176877 0.79 FKBP1A (0.39) ALDH1A1CALM1HPGDALOX15ALOX12
SCHEMBL3889020 0.79 TDP1 (0.48) ALDH1A1CALM1HPGDALOX15ALOX12
SCHEMBL8600509 0.79 TP53 (0.46) ALDH1A1CALM1HPGDALOX15ALOX12
SCHEMBL8597739 0.77 TAAR1 (0.41) ALDH1A1CALM1HPGDALOX15ALOX12

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 1674 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-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-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-114957527-A Polyisoprene containing cis-1, 4-and trans-1, 4-stereoblocks and preparation method thereof 中国石油化工股份有限公司 2022-08-30 CN claimed
CN-114957526-A Stereoblock poly-conjugated diene and preparation method thereof 中国石油化工股份有限公司 2022-08-30 CN claimed
CN-113368903-A Three-component composite catalyst for preparing hydrogenated polymer 浙江众立合成材料科技股份有限公司 2021-09-10 CN claimed
CN-110092855-B Rare earth complex, catalyst and preparation method thereof, and preparation method of diolefin polymer 中国科学院长春应用化学研究所 2021-03-02 CN claimed
CN-110144025-B Preparation method of rare earth catalyst and application of rare earth catalyst in diolefin polymerization and copolymerization 中国科学院长春应用化学研究所 2020-08-25 CN claimed
CN-107586369-B A kind of preparation method of trans- more than 1,4 block polybutadienes of cis- 1,4- 中国科学院长春应用化学研究所 2019-09-13 CN claimed
EP-0170384-A2 Polymerization catalyst EXXON RESEARCH AND ENGINEERING COMPANY (US) 1986-02-05 EP claimed
US-4562170-A Polymerization catalyst EXXON RESEARCH & ENGINEERING CO. (US) 1985-12-31 US claimed
US-4554265-A POLYOLEFINS HAVING BROAD MOLECULAR WEIGHT DISTRIBUTION EXXON RESEARCH & ENGINEERING CO. (US) 1985-11-19 US claimed
EP-0014338-B1 CATALYST, CATALYST COMPONENT AND PROCESS FOR THE POLYMERIZATION OF OLEFINS PHILLIPS PETROLEUM COMPANY (US) 1983-09-28 EP claimed
US-4366086-A Composition containing chlorine, bromine and magnesium GULF RESEARCH & DEVELOPMENT COMPANY (US) 1982-12-28 US claimed
US-4349483-A Process for the preparation of aluminum trihydrocarbyls GULF RESEARCH & DEVELOPMENT COMPANY (US) 1982-09-14 US claimed
US-4328123-A COMPRISING AN ALUMINUM HYDROCARBYL, A SUPPORT FROM AN ORGANO MAGNESIUM COMPOUND AND AN SLUMINUM HALIDE, AND TITANIUM TETRACHLORIDE GULF RESEARCH & DEVELOPMENT COMPANY (US) 1982-05-04 US claimed
US-4321347-A Process for the polymerization of olefins GULF RESEARCH & DEVELOPMENT CO. (US) 1982-03-23 US claimed
US-4235746-A MAGNESIUM-TITANIUM COORDINATION CATALYST PHILLIPS PETROLEUM COMPANY (US) 1980-11-25 US claimed
EP-0014338-A1 Catalyst, catalyst component and process for the polymerization of olefins PHILLIPS PETROLEUM COMPANY (US) 1980-08-20 EP claimed