SCHEMBL4772088

SCHEMBL4772088

C=C(C)c1cccc(C(C)C)c1O

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 7/20 0.61
GABRB1 P18505 5/20 0.61
GABRB2 P47870 3/20 0.61
GABRG2 P18507 2/20 0.61
GABRB3 P28472 2/20 0.61
CA1 P00915 2/20 0.61
CA2 P00918 2/20 0.61
CYP1A2 P05177 2/20 0.61
CYP3A4 P08684 2/20 0.61
LMNA P02545 2/20 0.61
FAAH O00519 1/20 0.61
HPGD P15428 1/20 0.61
TSHR P16473 1/20 0.61
PTGS1 P23219 1/20 0.61
SLC6A2 P23975 1/20 0.61
HTR2C P28335 1/20 0.61
GABRA5 P31644 1/20 0.61
GABRA3 P34903 1/20 0.61
HTR2B P41595 1/20 0.61
GABRA2 P47869 1/20 0.61

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
SCHEMBL1362730 0.83 GABRA1 (0.50) GABRA1GABRB1GABRB2GABRG2GABRB3
Hydrogen Peroxide SCHEMBL9619640 0.81 GABRA1 (0.48) GABRA1GABRB1GABRB2GABRG2GABRB3
SCHEMBL5443939 0.80 ALDH1A1 (0.39) GABRA1GABRB1GABRB2GABRG2GABRB3
SCHEMBL5574050 0.80 GABRA1 (0.45) GABRA1GABRB1GABRB2GABRG2GABRB3
SCHEMBL429128 0.80 GABRA1 (0.61) GABRA1GABRB1GABRB2GABRG2GABRB3
SCHEMBL5145459 0.80 GABRA1 (0.45) GABRA1GABRB1GABRB2GABRG2GABRB3
SCHEMBL13624336 0.80 GABRA1 (0.61) GABRA1GABRB1GABRB2GABRG2GABRB3
SCHEMBL29484676 0.80 GABRA1 (0.61) GABRA1GABRB1GABRB2GABRG2GABRB3
SCHEMBL23590451 0.78 GABRA1 (0.43) GABRA1GABRB1GABRB2GABRG2GABRB3
SCHEMBL6203469 0.78 GABRA1 (0.43) GABRA1GABRB1GABRB2GABRG2GABRB3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024258458-A1 HALOGENATED OLEFIN-CONTAINING POLYURETHANE FOAM-FORMING COMPOSITIONS, RELATED FOAMS AND METHODS FOR THEIR PRODUCTION COVESTRO LLC (US) 2024-12-19 WO claimed
CN-109320711-A A kind of cumenyl poly carboxylic acid series water reducer polyether macromonomer and its preparation method and application 上海东大化学有限公司 2019-02-12 CN claimed
CN-106589343-A Method for synthesizing cumenyl polyether 浙江皇马科技股份有限公司 2017-04-26 CN claimed
CN-105399939-A A synthetic method of cumenyl polyoxyethylene ether ZHEJIANG HUANGMA TECH CO LTD 2016-03-16 CN claimed
EP-1675885-B1 UNSATURATED MACROMERS FOR PREPARING PREFORMED STABILIZERS AND POLYMER POLYOLS BAYER MATERIALSCIENCE LLC (US) 2008-03-05 EP claimed
US-20050085613-A1 Novel unsaturated macromers for preformed stabilizers and polymer polyols BAYER MATERIALSCIENCE LLC 2005-04-21 US claimed
WO-2024258458-A1 HALOGENATED OLEFIN-CONTAINING POLYURETHANE FOAM-FORMING COMPOSITIONS, RELATED FOAMS AND METHODS FOR THEIR PRODUCTION COVESTRO LLC (US) 2024-12-19 WO disclosed
CN-119118856-A Isopropyl phenol compound and preparation method and application thereof 中山万汉制药有限公司 2024-12-13 CN disclosed
CN-109320711-A A kind of cumenyl poly carboxylic acid series water reducer polyether macromonomer and its preparation method and application 上海东大化学有限公司 2019-02-12 CN disclosed
CN-106589343-A Method for synthesizing cumenyl polyether 浙江皇马科技股份有限公司 2017-04-26 CN disclosed
CN-105399939-A A synthetic method of cumenyl polyoxyethylene ether ZHEJIANG HUANGMA TECH CO LTD 2016-03-16 CN disclosed
EP-1675885-B1 UNSATURATED MACROMERS FOR PREPARING PREFORMED STABILIZERS AND POLYMER POLYOLS BAYER MATERIALSCIENCE LLC (US) 2008-03-05 EP disclosed
EP-1675885-A2 UNSATURATED MACROMERS FOR PREPARING PREFORMED STABILIZERS AND POLYMER POLYOLS Bayer MaterialScience LLC (US) 2006-07-05 EP disclosed
US-20050085613-A1 Novel unsaturated macromers for preformed stabilizers and polymer polyols BAYER MATERIALSCIENCE LLC 2005-04-21 US disclosed
EP-0862544-B1 PROCESS FOR PURIFYING A 2,6-DIALKYLPHENOL ALBEMARLE CORP (US) 2001-01-03 EP disclosed
EP-0862544-A1 PROCESS FOR PURIFYING A 2,6-DIALKYLPHENOL ALBEMARLE CORPORATION (US) 1998-09-09 EP disclosed
US-5705039-A CONTINUOUS DISTILLATION IN OXIDATION RESISTANT ENVIRONMENT ALBEMARLE CORPORATION (US) 1998-01-06 US disclosed
US-5705039-A CONTINUOUS DISTILLATION IN OXIDATION RESISTANT ENVIRONMENT ALBEMARLE CORPORATION (US) 1998-01-06 US disclosed
WO-1997015542-A1 PROCESS FOR PURIFYING A 2,6-DIALKYLPHENOL ALBEMARLE CORPORATION (US) 1997-05-01 WO disclosed
US-5591311-A 2,6-DIISOPROPYLPHENOL ALBEMARLE CORPORATION (US) 1997-01-07 US disclosed