SCHEMBL825972

SCHEMBL825972

Cc1cccc(C(C)C)c1C(C)C

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.48
GABRA1 P14867 3/20 0.48
CA1 P00915 3/20 0.48
CA2 P00918 3/20 0.48
CYP1A2 P05177 3/20 0.48
GABRG2 P18507 2/20 0.48
GABRB3 P28472 2/20 0.48
GABRB2 P47870 2/20 0.48
LMNA P02545 2/20 0.48
CYP3A4 P08684 2/20 0.48
SLC6A2 P23975 2/20 0.48
FAAH O00519 1/20 0.48
HPGD P15428 1/20 0.48
GABRB1 P18505 1/20 0.48
PTGS1 P23219 1/20 0.48
HTR2C P28335 1/20 0.48
GABRA5 P31644 1/20 0.48
GABRA3 P34903 1/20 0.48
HTR2B P41595 1/20 0.48
GABRA2 P47869 1/20 0.48

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 SCHEMBL8443355 0.95 GABRA1 (0.50) TSHRGABRA1CA1CA2CYP1A2
Carbimide SCHEMBL28720207 0.91 GABRA1 (0.41) TSHRGABRA1CA1CA2CYP1A2
SCHEMBL29160572 0.88 GABRA1 (0.39) TSHRGABRA1CA1CA2CYP1A2
SCHEMBL19644552 0.86 GABRA1 (0.44) TSHRGABRA1CA1CA2CYP1A2
SCHEMBL19682797 0.84 P2RX7 (0.39) TSHRGABRA1CA1CA2CYP1A2
SCHEMBL66227 0.84 GABRA1 (0.57) TSHRGABRA1CA1CA2CYP1A2
SCHEMBL598366 0.84 CA1 (0.50) TSHRGABRA1CA1CA2CYP1A2
SCHEMBL3945130 0.83 GABRA1 (0.39) TSHRGABRA1CA1CA2CYP1A2
SCHEMBL3945132 0.83 GABRA1 (0.39) TSHRGABRA1CA1CA2CYP1A2
Benzene SCHEMBL7864298 0.81 GABRA1 (0.55) TSHRGABRA1CA1CA2CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109438157-B Process for producing cumene 巴杰许可有限责任公司 2024-05-14 CN claimed
CN-111039743-B Method for isomerizing isopropyl toluene by using solid catalyst 浙江新和成股份有限公司 2022-07-05 CN claimed
CN-111039743-A Method for isomerizing isopropyl toluene by using solid catalyst 浙江新和成股份有限公司 2020-04-21 CN claimed
EP-2867191-B1 PROCESS FOR PRODUCING CUMENE BADGER LICENSING LLC (US) 2019-09-11 EP claimed
CN-109438157-A The method for producing cumene 巴杰许可有限责任公司 2019-03-08 CN claimed
US-9850187-B2 Process for producing cumene BADGER LICENSING LLC (US) 2017-12-26 US claimed
US-20150183695-A1 PROCESS FOR PRODUCING CUMENE BADGER LICENSING LLC (US) 2015-07-02 US claimed
EP-2867191-A1 PROCESS FOR PRODUCING CUMENE Badger Licensing, LLC (US) 2015-05-06 EP claimed
WO-2014003732-A1 PROCESS FOR PRODUCING CUMENE BADGER LICENSING LLC (US) 2014-01-03 WO claimed
EP-0914310-B1 AROMATIC CONVERSION PROCESSES AND ZEOLITE CATALYST USEFUL THEREIN EXXONMOBIL CHEM PATENTS INC (US) 2003-10-01 EP claimed
EP-0018803-B1 PROCESS FOR PREPARATION OF AROMATIC TERTIARY HYDROPEROXIDES AND PHENOLS PREPARED THEREFROM MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1982-05-12 EP claimed
US-4314091-A Preparation of 1-methyl-3,5-diisopropyl benzene from charge streams containing diisopropyl toluene TEXACO INC. (US) 1982-02-02 US claimed
US-4297508-A BY REACTING CARBON DIOXIDE WITH B-NAPHTHOL, AN ALKALI METAL SALT OF B-NAPHTHOL, AND AN ALKYLBENZENE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1981-10-27 US claimed
US-4288637-A COPPER PEROXIDATION CATALYSTS MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1981-09-08 US claimed
EP-0018803-A1 Process for preparation of aromatic tertiary hydroperoxides and phenols prepared therefrom MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1980-11-12 EP claimed
US-4108907-A Process for the preparation of polyalkylbenzene hydroperoxides KOPPERS COMPANY, INC. (US) 1978-08-22 US claimed
US-3969420-A Process for recovering resorcinol and hydroquinone in mixture SUMITOMO CHEMICAL COMPANY, LIMITED (JA) 1976-07-13 US claimed
US-3962366-A COMPLEXING, HYDROGEN FLUORIDE, BORON TRIFLUORIDE SOCIETE CHIMIQUE DES CHARBONNAGES (FR) 1976-06-08 US claimed
US-3952037-A Aluminum catalysts SUMITOMO CHEMICAL COMPANY, LIMITED (JA) 1976-04-20 US claimed
US-3933921-A Process for the production of hydroperoxides SUMITOMO CHEMICAL COMPANY, LIMITED (JA) 1976-01-20 US claimed