SCHEMBL5145459

SCHEMBL5145459

C=C(C)c1cccc(C(C)C)c1C(=C)C

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 3/20 0.45
GABRG2 P18507 2/20 0.45
GABRB3 P28472 2/20 0.45
GABRB2 P47870 2/20 0.45
LMNA P02545 2/20 0.45
FAAH O00519 1/20 0.45
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
CYP1A2 P05177 1/20 0.45
CYP3A4 P08684 1/20 0.45
HPGD P15428 1/20 0.45
TSHR P16473 1/20 0.45
GABRB1 P18505 1/20 0.45
PTGS1 P23219 1/20 0.45
SLC6A2 P23975 1/20 0.45
HTR2C P28335 1/20 0.45
GABRA5 P31644 1/20 0.45
GABRA3 P34903 1/20 0.45
HTR2B P41595 1/20 0.45
GABRA2 P47869 1/20 0.45

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) GABRA1GABRG2GABRB3GABRB2LMNA
Hydrogen Peroxide SCHEMBL9619640 0.81 GABRA1 (0.48) GABRA1GABRG2GABRB3GABRB2LMNA
SCHEMBL329566 0.80 THRB (0.33) KMT2AADRA2AADRA2BADRA2C
SCHEMBL5574050 0.80 GABRA1 (0.45) GABRA1GABRG2GABRB3GABRB2LMNA
SCHEMBL4772088 0.80 GABRA1 (0.61) GABRA1GABRG2GABRB3GABRB2LMNA
SCHEMBL26204110 0.78 GABRA1 (0.43) GABRA1GABRG2GABRB3GABRB2LMNA
SCHEMBL23590451 0.78 GABRA1 (0.43) GABRA1GABRG2GABRB3GABRB2LMNA
SCHEMBL6203469 0.78 GABRA1 (0.43) GABRA1GABRG2GABRB3GABRB2LMNA
SCHEMBL19443687 0.76 GABRA1 (0.41) GABRA1GABRG2GABRB3GABRB2LMNA
SCHEMBL2722420 0.73 GABRA1 (0.56) GABRA1GABRG2GABRB3GABRB2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7226964-B2 Composition comprising a nitroxide, a promoter and optionally a free-radical initiator ARKEMA FRANCE (FR) 2007-06-05 US claimed
US-20040195550-A1 Composition comprising a nitroxide, a promoter and optionally a free-radical initiator ATOFINA 2004-10-07 US claimed
EP-1322696-B1 COMPOSITION COMPRISING A NITROXIDE, A PROMOTER AND OPTIONALLY A FREE RADICAL INITIATOR ATOFINA (FR) 2004-08-25 EP claimed
EP-1446397-A1 NOVEL MANDELATE SALTS OF SUBSTITUTED TETRACYCLIC TETRAHYDROFURAN DERIVATIVES JANSSEN PHARMACEUTICA N.V. (BE) 2004-08-18 EP claimed
US-6743959-B1 CHROMIUM FREE CATALYTIC SYNTHESIS OF UNSATURATED CHEMICAL INTERMEDIATES MITSUI CHEMICALS, INC. (JP) 2004-06-01 US claimed
WO-2003040122-A1 NOVEL MANDELATE SALTS OF SUBSTITUTED TETRACYCLIC TETRAHYDROFURAN DERIVATIVES JANSSEN PHARMACEUTICA N.V. (BE) 2003-05-15 WO claimed
EP-1219582-A1 METHOD OF DEHYDROGENATING TRIISOPROPYLBENZENE AND DIISOPROPYLBENZENE Mitsui Chemicals, Inc. (JP) 2002-07-03 EP claimed
EP-0522729-B1 Composition for cross linking ethylene polymer, method for cross linking the polymer, and electric power cable providing the cross linked polymer NIPPON OILS & FATS CO LTD (JP) 1995-11-02 EP claimed
EP-0522729-A1 Composition for cross linking ethylene polymer, method for cross linking the polymer, and electric power cable providing the cross linked polymer NIPPON OIL AND FATS COMPANY, LIMITED (JP) 1993-01-13 EP claimed
JP-5178944-A None JP disclosed
US-11753522-B2 Use of magnesium oxide for crosslinking polymers ARKEMA FRANCE (FR) 2023-09-12 US disclosed
CN-110072933-B Tire comprising a polyindane resin and use thereof 伊士曼化工公司 2022-04-05 CN disclosed
CN-110072962-B Adhesive comprising a polyindane resin 伊士曼化工公司 2021-10-19 CN disclosed
EP-3555188-B1 TIRES COMPRISING POLYINDANE RESINS AND USES THEREOF EASTMAN CHEM CO (US) 2021-07-14 EP disclosed
WO-2002028946-A1 COMPOSITION COMPRISING A NITROXIDE, A PROMOTER AND OPTIONALLY A FREE RADICAL INITIATOR ATOFINA (FR) 2002-04-11 WO disclosed
WO-2001016062-A1 METHOD OF DEHYDROGENATING TRIISOPROPYLBENZENE AND DIISOPROPYLBENZENE MITSUI CHEMICALS, INCORPORATED (JP) 2001-03-08 WO disclosed
EP-0522729-B1 Composition for cross linking ethylene polymer, method for cross linking the polymer, and electric power cable providing the cross linked polymer NIPPON OILS & FATS CO LTD (JP) 1995-11-02 EP disclosed
US-5252676-A Diisopropenyl benzene and either dicumyl peroxide or bis (tert-butylperoxyisopropyl) benzene NIPPON OIL & FATS CO., LTD. (JP) 1993-10-12 US disclosed
JP-H05178944-A COMPOSITION AND PROCESS FOR CROSS-LINKING ETHYLENIC POLYMER AND POWER CABLE NIPPON OIL & FATS CO LTD 1993-07-20 JP disclosed
EP-0522729-A1 Composition for cross linking ethylene polymer, method for cross linking the polymer, and electric power cable providing the cross linked polymer NIPPON OIL AND FATS COMPANY, LIMITED (JP) 1993-01-13 EP disclosed