SCHEMBL44978

SCHEMBL44978

COC(C)(C)c1cc(C(C)(C)C)cc(C(C)(C)OC)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 1/20 0.48
GABRB2 P47870 1/20 0.48
HSD17B10 Q99714 2/20 0.39
POLB P06746 1/20 0.39
KDM4E B2RXH2 1/20 0.35
GAA P10253 1/20 0.35
MAPT P10636 1/20 0.35
RXRA P19793 3/20 0.33
RXRB P28702 3/20 0.33
RXRG P48443 2/20 0.33
HTR1D P28221 2/20 0.33
F2R P25116 1/20 0.33
HMGCR P04035 2/20 0.32
ALDH1A1 P00352 2/20 0.32
HPGD P15428 1/20 0.32
ALOX15 P16050 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
TSHR P16473 1/20 0.32
CYP2C19 P33261 1/20 0.31
LMNA P02545 1/20 0.31

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
SCHEMBL3262455 1.00 GABRA1 (0.48) GABRA1GABRB2HSD17B10POLBKDM4E
SCHEMBL45192 0.91 HSD17B10 (0.38) GABRA1GABRB2HSD17B10ALDH1A1ALOX15
SCHEMBL15726942 0.91 GABRA1 (0.41) GABRA1GABRB2HSD17B10POLBKDM4E
SCHEMBL26016667 0.89 GABRA1 (0.39) GABRA1GABRB2HSD17B10POLBKDM4E
SCHEMBL15132423 0.89 GABRA1 (0.44) GABRA1GABRB2HSD17B10POLBKDM4E
SCHEMBL14994436 0.89 GABRA1 (0.39) GABRA1GABRB2HSD17B10POLBKDM4E
SCHEMBL15723309 0.85 GABRA1 (0.37) GABRA1GABRB2HSD17B10POLBHMGCR
SCHEMBL17426001 0.83 LMNA (0.41) GABRA1GABRB2HSD17B10MAPTRXRA
SCHEMBL25736519 0.82 RXRB (0.51) GABRA1GABRB2HSD17B10MAPTRXRA
SCHEMBL12500725 0.80 HDAC8 (0.44) GABRA1GABRB2HSD17B10POLBGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120118222-A Method for continuously photochemically synthesizing telechelic polymer by utilizing micro-reaction device and application thereof 北京石油化工学院 2025-06-10 CN claimed
CN-117887093-B Macromolecular branching agent, star-branched polymer and preparation method and application thereof 浙江信汇新材料股份有限公司 2025-04-29 CN claimed
CN-119735767-A Method for preparing polyisobutene and block copolymer thereof by Fe system coinitiator 北京石油化工学院 2025-04-01 CN claimed
CN-118085149-A Comb-shaped special elastomer with excellent damping performance and preparation method thereof 北京石油化工学院 2024-05-28 CN claimed
CN-117887093-A Macromolecular branching agent, star-branched polymer and preparation method and application thereof 浙江信汇新材料股份有限公司 2024-04-16 CN claimed
CN-114395064-B Preparation method for increasing polymerization temperature of polyisomonoolefin elastomer or molecular weight of elastomer 北京石油化工学院 2024-03-15 CN claimed
CN-117343223-A Branched halogenated polyisobutenyl elastomer and preparation method and application thereof 北京石油化工学院 2024-01-05 CN claimed
CN-117186149-A Nitrogen-phosphorus compounds and their use for preparing polyisobutene of high/ultra-high molecular weight 盘锦信汇新材料有限公司 2023-12-08 CN claimed
CN-111285948-B Method for preparing halogenated polyisobutenyl special elastomer by one-step method and application 北京石油化工学院 2022-12-09 CN claimed
CN-114395064-A Preparation method for improving polymerization temperature of polyisomonoolefin-based elastomer or molecular weight of elastomer 北京石油化工学院 2022-04-26 CN claimed
WO-2004067577-A2 POLYMERIZATION PROCESSES EXXONMOBIL CHEMICAL PATENTS INC. (US) 2004-08-12 WO claimed
WO-2004058829-A1 POLYMERIZATION PROCESSES EXXONMOBIL CHEMICAL PATENTS, INC. (US) 2004-07-15 WO claimed
WO-2004058836-A1 POLYMERS WITH NEW SEQUENCE DISTRIBUTIONS EXXONMOBIL CHEMICAL PATENTS INC. (US) 2004-07-15 WO claimed
WO-2004058827-A1 POLYMERIZATION PROCESSES EXXONMOBIL CHEMICAL PATENTS INC. (US) 2004-07-15 WO claimed
WO-2004058835-A1 POLYMERS SUBSTANTIALLY FREE OF LONG CHAIN BRANCHING EXXONMOBIL CHEMICAL PATENTS INC. (US) 2004-07-15 WO claimed
WO-2004058828-A1 POLYMERIZATION PROCESSES EXXONMOBIL CHEMICAL PATENTS INC. (US) 2004-07-15 WO claimed
WO-2004058825-A2 POLYMERS WITH NEW SEQUENCE DISTRIBUTIONS EXXONMOBIL CHEMICAL PATENTS, INC. (US) 2004-07-15 WO claimed
US-RE34640-E Polymerizing isobutylene, adding monomer to make block polymer; metal halide, initiator and electron pair doner solvent UNIVERSITY OF AKRON (US) 1994-06-14 US claimed
WO-1991011468-A1 NEW THERMOPLASTIC ELASTOMERS THE UNIVERSITY OF AKRON (US) 1991-08-08 WO claimed
US-4946899-A CARBOCATIONIC POLYMERIZATION INVOLVING HOMOPOLYMERIZATION OF ELASTOMER FOLLOWED BY COPOLYMERIZATION TO ADD GLASSY SEGMENTS; FORMING LIVING POLYMERS WITH A METAL HALIDE, PROMOTER AND SOLVENT MIXTURE THE UNIVERSITY OF AKRON (US) 1990-08-07 US claimed