SCHEMBL756579

SCHEMBL756579

CC(C)C=CC(=O)C=CC(C)C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRP O00591 2/20 0.43
GABRD O14764 2/20 0.43
GABRA1 P14867 2/20 0.43
GABRB1 P18505 2/20 0.43
GABRG2 P18507 2/20 0.43
GABRB3 P28472 2/20 0.43
GABRA5 P31644 2/20 0.43
GABRA3 P34903 2/20 0.43
GABRA2 P47869 2/20 0.43
GABRB2 P47870 2/20 0.43
GABRA4 P48169 2/20 0.43
GABRE P78334 2/20 0.43
GABRA6 Q16445 2/20 0.43
GABRG1 Q8N1C3 2/20 0.43
GABRG3 Q99928 2/20 0.43
GABRQ Q9UN88 2/20 0.43
ALDH1A1 P00352 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
TAS1R3 Q7RTX0 1/20 0.36
TAS1R1 Q7RTX1 1/20 0.36

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
SCHEMBL12851470 1.00 GABRP (0.43) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL6762314 0.89 GABRP (0.37) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL6762316 0.89 GABRP (0.37) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL6762317 0.89 GABRP (0.37) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL12854716 0.89 GABRP (0.37) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL26198762 0.85
SCHEMBL26198767 0.83
SCHEMBL17639990 0.81 ALDH1A1 (0.36) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL3614961 0.78
SCHEMBL3614963 0.78

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4401745-A Composition and process for ultra-fine pattern formation TOKYO OHKA KOGYO CO., LTD. (JP) 1983-08-30 US claimed
EP-3184448-B1 MULTILAYER PLASTIC CONTAINER MITSUBISHI GAS CHEMICAL CO (JP) 2019-04-03 EP disclosed
EP-2634839-B1 SECONDARY BATTERY POROUS MEMBRANE, SLURRY FOR SECONDARY BATTERY POROUS MEMBRANE, AND SECONDARY BATTERY ZEON CORP (JP) 2018-02-21 EP disclosed
US-20170267436-A1 MULTILAYER PLASTIC CONTAINER MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2017-09-21 US disclosed
EP-3184448-A1 MULTILAYER PLASTIC CONTAINER Mitsubishi Gas Chemical Company, Inc. (JP) 2017-06-28 EP disclosed
US-9437856-B2 Secondary battery porous membrane, slurry for secondary battery porous membrane, and secondary battery ZEON CORPORATION (JP) 2016-09-06 US disclosed
US-8815472-B2 Volume hologram optical recording medium, composition for volume hologram recording layer formation, and volume hologram recording material MITSUBISHI CHEMICAL CORPORATION (JP) 2014-08-26 US disclosed
US-20130266873-A1 SECONDARY BATTERY POROUS MEMBRANE, SLURRY FOR SECONDARY BATTERY POROUS MEMBRANE, AND SECONDARY BATTERY ZEON CORPORATION (JP) 2013-10-10 US disclosed
EP-2634839-A1 SECONDARY BATTERY POROUS MEMBRANE, SLURRY FOR SECONDARY BATTERY POROUS MEMBRANE, AND SECONDARY BATTERY Zeon Corporation (JP) 2013-09-04 EP disclosed
EP-2077471-B1 VOLUME HOLOGRAM OPTICAL RECORDING MEDIUM, COMPOSITION FOR VOLUME HOLOGRAM RECORDING LAYER FORMATION, AND VOLUME HOLOGRAM RECORDING MATERIAL MITSUBISHI CHEM CORP (JP) 2012-07-25 EP disclosed
EP-0218782-A1 Lipoxygenase-inhibiting composition and hydroxyphenylthioalkylcarbonyl compounds G.D. Searle & Co. (US) 1987-04-22 EP disclosed
US-4560776-A ALDEHYDES, ANHYDRIDES, ACID CATALYST INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1985-12-24 US disclosed
US-4495359-A Prins reaction products of diisoamylene, derivatives thereof, organoleptic uses thereof and processes for preparing same INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1985-01-22 US disclosed
US-4429151-A PERFUMES, FLAVORS INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1984-01-31 US disclosed
US-4413639-A Use of prins and derivatives thereof in augmenting or enhancing the aroma or taste of a smoking tobacco composition or smoking tobacco article component INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1983-11-08 US disclosed
US-4395425-A Use of Prins reaction products of diisoamylene derivatives to augment or enhance the aroma or taste of foodstuffs INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1983-07-26 US disclosed
US-4394285-A PERFUMED DETERGENT INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1983-07-19 US disclosed
US-4381242-A Organoleptic use of Prins reaction products of diisoamylene, derivatives thereof, organoleptic uses thereof and processes for preparing same INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1983-04-26 US disclosed
US-4374053-A Unsaturated aldehydes, organoleptic uses thereof and process for preparing same INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1983-02-15 US disclosed
US-4359412-A Organoleptic use of Prins reaction products of diisoamylene derivatives INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1982-11-16 US disclosed