SCHEMBL1362730

SCHEMBL1362730

C=C(C)c1ccccc1C(C)C

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 3/20 0.50
GABRB2 P47870 2/20 0.50
GABRG2 P18507 2/20 0.46
GABRB3 P28472 2/20 0.46
LMNA P02545 2/20 0.46
TSHR P16473 2/20 0.46
FAAH O00519 2/20 0.46
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
CYP1A2 P05177 1/20 0.46
CYP3A4 P08684 1/20 0.46
HPGD P15428 1/20 0.46
GABRB1 P18505 1/20 0.46
PTGS1 P23219 1/20 0.46
SLC6A2 P23975 1/20 0.46
HTR2C P28335 1/20 0.46
GABRA5 P31644 1/20 0.46
GABRA3 P34903 1/20 0.46
HTR2B P41595 1/20 0.46
GABRA2 P47869 1/20 0.46

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
Hydrogen Peroxide SCHEMBL9619640 0.98 GABRA1 (0.48) GABRA1GABRB2GABRG2GABRB3LMNA
SCHEMBL7550549 0.86 GABRA1 (0.37) GABRA1GABRB2GABRG2GABRB3LMNA
SCHEMBL27844762 0.85 CYP2D6 (0.39) GABRA1GABRB2GABRG2GABRB3LMNA
SCHEMBL487601 0.84 HPGD (0.35) GABRA1GABRB2GABRG2GABRB3LMNA
SCHEMBL4772088 0.83 GABRA1 (0.61) GABRA1GABRB2GABRG2GABRB3LMNA
SCHEMBL5145459 0.83 GABRA1 (0.45) GABRA1GABRB2GABRG2GABRB3LMNA
SCHEMBL5574050 0.83 GABRA1 (0.45) GABRA1GABRB2GABRG2GABRB3LMNA
SCHEMBL23590451 0.81 GABRA1 (0.43) GABRA1GABRB2GABRG2GABRB3LMNA
SCHEMBL9064199 0.81 TYR (0.44) LMNAHPGDHIF1AADRA2AADRA2C
SCHEMBL6203469 0.81 GABRA1 (0.43) GABRA1GABRB2GABRG2GABRB3LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1803700-A2 Method for the dehydrogenation of diisopropyl benezene Mitsui Chemicals, Inc. (JP) 2007-07-04 EP claimed
US-6743959-B1 CHROMIUM FREE CATALYTIC SYNTHESIS OF UNSATURATED CHEMICAL INTERMEDIATES MITSUI CHEMICALS, INC. (JP) 2004-06-01 US claimed
EP-1219582-A1 METHOD OF DEHYDROGENATING TRIISOPROPYLBENZENE AND DIISOPROPYLBENZENE Mitsui Chemicals, Inc. (JP) 2002-07-03 EP claimed
EP-0155223-B1 PROCESS FOR THE SYNTHESIS AND PURIFICATION DIISOPROPENYLBENZENE THE GOODYEAR TIRE & RUBBER COMPANY (US) 1989-04-19 EP claimed
EP-0155223-A1 Process for the synthesis and purification diisopropenylbenzene THE GOODYEAR TIRE & RUBBER COMPANY (US) 1985-09-18 EP claimed
US-4528413-A Process for the synthesis and purification of diisopropenylbenzene THE GOODYEAR TIRE & RUBBER COMPANY (US) 1985-07-09 US claimed
US-3950431-A EXTRACTION WITH A SOLUTION OF AN ALCOHOL AND SODIUM HYDROXIDE OR SODIUM CARBONATE SUMITOMO CHEMICAL COMPANY, LIMITED (JA) 1976-04-13 US claimed
CN-119684099-A Preparation method of 3- (3-isopropylphenyl) butyraldehyde 西安凯立新材料股份有限公司 2025-03-25 CN disclosed
US-11739208-B2 Block copolymers and uses thereof Kraton Corporation (US) 2023-08-29 US disclosed
US-11555085-B2 Block copolymers and uses thereof KRATON POLYMERS LLC (US) 2023-01-17 US disclosed
EP-3960780-A1 BLOCK COPOLYMERS AND USES THEREOF Kraton Polymers Research B.V. (NL) 2022-03-02 EP disclosed
CN-108780288-B Positively chargeable black toner 日本瑞翁株式会社 2022-03-01 CN disclosed
CN-107430364-B Method for producing negatively chargeable toner and negatively chargeable toner 日本瑞翁株式会社 2021-08-17 CN disclosed
EP-0155223-A1 Process for the synthesis and purification diisopropenylbenzene THE GOODYEAR TIRE & RUBBER COMPANY (US) 1985-09-18 EP disclosed
US-4528413-A Process for the synthesis and purification of diisopropenylbenzene THE GOODYEAR TIRE & RUBBER COMPANY (US) 1985-07-09 US disclosed
EP-0021848-B1 PROCESS AND APPARATUS FOR THE PREPARATION OF PHENOLS MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1983-04-13 EP disclosed
US-4334108-A Process and apparatus for preparation of phenols MITSU PETROCHEMICAL INDUSTRIES LTD. (JP) 1982-06-08 US disclosed
EP-0021848-A1 Process and apparatus for the preparation of phenols MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1981-01-07 EP disclosed
US-3975278-A Tractants comprising linear dimers of α-alkyl styrene MONSANTO COMPANY (US) 1976-08-17 US disclosed
US-3950431-A EXTRACTION WITH A SOLUTION OF AN ALCOHOL AND SODIUM HYDROXIDE OR SODIUM CARBONATE SUMITOMO CHEMICAL COMPANY, LIMITED (JA) 1976-04-13 US disclosed