Isopropylbenzene

Isopropylbenzene

SCHEMBL308436

CC(C)c1ccccc1.[KH]

nearest known ligand 0.55

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Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ TAAR1 Q96RJ0 4/20 0.48
▸ KDM4E B2RXH2 2/20 0.46
▸ ADRA2A P08913 1/20 0.46
▸ ADRA2C P18825 1/20 0.46
▸ CYP2D6 P10635 1/20 0.46
▸ LMNA P02545 1/20 0.46
▸ HIF1A Q16665 1/20 0.46
▸ DPP4 P27487 2/20 0.45
▸ F2 P00734 1/20 0.45
▸ TSHR P16473 1/20 0.45
▸ ALDH1A1 P00352 2/20 0.44
▸ MIF P14174 2/20 0.42

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
Isopropylbenzene SCHEMBL28421110 0.97 ADRA2C (0.50) TAAR1KDM4EADRA2AADRA2CCYP2D6
Isopropylbenzene SCHEMBL8431863 0.97 TAAR1 (0.50) TAAR1KDM4EADRA2AADRA2CCYP2D6
Isopropylbenzene SCHEMBL27727769 0.97 TAAR1 (0.50) TAAR1KDM4EADRA2AADRA2CCYP2D6
Isopropylbenzene SCHEMBL11254813 0.97 — —
Isopropylbenzene SCHEMBL6568 0.97 — —
Isopropylbenzene SCHEMBL3672803 0.97 TAAR1 (0.50) TAAR1KDM4EADRA2AADRA2CCYP2D6
Isopropylbenzene SCHEMBL87809 0.97 TAAR1 (0.50) TAAR1KDM4EADRA2AADRA2CCYP2D6
Isopropylbenzene SCHEMBL23421101 0.93 ADRA2C (0.52) TAAR1KDM4EADRA2AADRA2CCYP2D6
Isopropylbenzene SCHEMBL5162171 0.93 TAAR1 (0.48) TAAR1KDM4EADRA2AADRA2CCYP2D6
Isopropylbenzene SCHEMBL7041369 0.93 TAAR1 (0.48) TAAR1KDM4EADRA2AADRA2CCYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116836695-A W/O/W type multi-structure emulsified acid and preparation method and application thereof 中石化石油工程技术服务有限公司 2023-10-03 — — CN claimed
CN-104389216-A Method for separating lignin and holocellulose from wood fiber raw material and application INT CT BAMBOO & RATTAN 2015-03-04 — — CN claimed
CN-118843682-A Antifungal composition 联合利华知识产权控股有限公司 2024-10-25 — — CN disclosed
EP-3850016-B1 OPTICALLY BRIGHTENED LATEXES ARCHROMA IP GMBH (CH) 2024-09-11 — — EP disclosed
US-11866525-B2 Optically brightened latexes ARCHROMA IP GMBH 2024-01-09 — — US disclosed
CN-116836695-A W/O/W type multi-structure emulsified acid and preparation method and application thereof 中石化石油工程技术服务有限公司 2023-10-03 — — CN disclosed
EP-3623392-B1 OPTICALLY BRIGHTENED LATEXES ARCHROMA IP GMBH (CH) 2023-07-19 — — EP disclosed
CN-112567013-B Benefit agent delivery particles 联合利华知识产权控股有限公司 2023-05-26 — — CN disclosed
CN-112469807-B Benefit agent delivery particles 联合利华知识产权控股有限公司 2022-07-26 — — CN disclosed
CN-111363069-B Preparation method of polyvinyl chloride resin composite initiator 乌鲁木齐市华泰隆化学助剂有限公司 2022-04-19 — — CN disclosed
US-20220049025-A1 OPTICALLY BRIGHTENED LATEXES ARCHROMA IP GMBH (CH) 2022-02-17 — — US disclosed
EP-0016518-A1 Ambient or low-temperature curable coating compositions for coating rigid substrates ROHM AND HAAS COMPANY (US) 1980-10-01 — — EP disclosed
EP-0015644-A2 Ambient or low-temperature curable coating compositions for leather and other flexible substrates and methods of using them ROHM AND HAAS COMPANY (US) 1980-09-17 — — EP disclosed
US-4210565-A COPOLYMERS OF ACRYLIC ALDEHYDES CURED WITH BIS- HYDRAZIDES OR HYDRAZONES ROHM AND HAAS COMPANY (US) 1980-07-01 — — US disclosed
US-4199400-A Migration-resistant binder compositions for bonding nonwoven fibers; also methods and articles ROHM AND HAAS COMPANY (US) 1980-04-22 — — US disclosed
US-4176108-A OF AN ACRYLATE OR VINYL ACETATE COPOLYMER CONTAINING HYDROXY ACRYLATE OR METHACRYLATE; A SURFACTANT AND A WATER SOLBULE SALT NATIONAL STARCH AND CHEMICAL CORPORATION (US) 1979-11-27 — — US disclosed
US-4119600-A ANIONICALLY-STABILIZED POLYMER LATEX, WATER-SOLUBLE POLYMER, VOLATILE BASE ROHM AND HAAS COMPANY (US) 1978-10-10 — — US disclosed
US-4016127-A Emulsion copolymers of acrolein and their use in treating leather ROHM AND HAAS COMPANY (US) 1977-04-05 — — US disclosed
US-4014806-A DETERGENT BUILDERS, AMINE SALTS CONNOR DAVID 1977-03-29 — — US disclosed
US-4009256-A NOVEL SHAMPOO COMPOSITION CONTAINING A WATER-SOLUBLE CATIONIC POLYMER NATIONAL STARCH AND CHEMICAL CORPORATION (US) 1977-02-22 — — US disclosed
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