SCHEMBL2023918

SCHEMBL2023918

C=C(C)C(C)(C)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.52
KMT2A Q03164 1/20 0.52
ALDH1A1 P00352 3/20 0.44
ALOX15 P16050 1/20 0.44
ESR1 P03372 3/20 0.43
ESR2 Q92731 3/20 0.43
CYP3A4 P08684 1/20 0.43
MAPK1 P28482 1/20 0.42
CYP2C19 P33261 1/20 0.40
HIF1A Q16665 1/20 0.40
TAAR1 Q96RJ0 1/20 0.39
HDAC3 O15379 1/20 0.39
HDAC4 P56524 1/20 0.39
HDAC1 Q13547 1/20 0.39
HDAC7 Q8WUI4 1/20 0.39
HDAC2 Q92769 1/20 0.39
HDAC10 Q969S8 1/20 0.39
HDAC11 Q96DB2 1/20 0.39
HDAC8 Q9BY41 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39

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
SCHEMBL2679726 0.88 MAPT (0.47) MAPTKMT2AALDH1A1ALOX15ESR1
SCHEMBL12407295 0.82 MAPT (0.54) MAPTKMT2AALDH1A1ALOX15ESR1
SCHEMBL9806389 0.82 MAPT (0.54) MAPTKMT2AALDH1A1ALOX15ESR1
SCHEMBL8613863 0.80 HDAC3 (0.48) MAPTKMT2AALDH1A1ALOX15ESR1
SCHEMBL20262938 0.80 ALDH1A1 (0.44) MAPTKMT2AALDH1A1ALOX15ESR1
SCHEMBL11505025 0.79 MAPT (0.56) MAPTKMT2AALDH1A1ALOX15ESR1
SCHEMBL19576140 0.78 ESR1 (0.54) MAPTKMT2AALDH1A1ESR1ESR2
SCHEMBL2246955 0.78 ALDH1A1 (0.43) MAPTKMT2AALDH1A1ALOX15ESR1
SCHEMBL2354195 0.78 MAPT (0.50) MAPTKMT2AALDH1A1ALOX15ESR1
SCHEMBL1171328 0.78 MAPT (0.55) MAPTKMT2AALDH1A1ALOX15ESR1

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 43 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
JP-10182512-A None JP disclosed
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
EP-3065944-B1 MODIFICATION OF POLYAMIDES ARKEMA INC (US) 2022-01-19 EP disclosed
US-10787604-B2 Colored organic peroxide compositions and methods for breaking fluids ARKEMA INC. (US) 2020-09-29 US disclosed
US-10358559-B2 Colored organic peroxide compositions ARKEMA INC. (US) 2019-07-23 US disclosed
US-10294414-B2 Compositions and methods for breaking hydraulic fracturing fluids ARKEMA INC. (US) 2019-05-21 US disclosed
US-10138413-B2 Promoters for peroxides in aqueous treatment fluids ARKEMA INC. (US) 2018-11-27 US disclosed
US-20180079952-A1 COLORED ORGANIC PEROXIDE COMPOSITIONS AND METHODS FOR BREAKING HYDRAULIC FRACTURING FLUIDS ARKEMA INC. 2018-03-22 US disclosed
JP-2001026558-A DEHYDROGENATION OF DIISOPROPYLBENZENE MITSUI CHEMICALS INC 2001-01-30 JP disclosed
JP-2000327596-A DEHYDROGENATION OF DIISOPROPYLBENZENE MITSUI CHEMICALS INC 2000-11-28 JP disclosed
JP-H10182512-A SEPARATION OF ISOPROPENYLBENZENES NIPPON STEEL CHEM CO LTD 1998-07-07 JP disclosed
EP-0102912-B1 A PROCESS FOR THE PURIFICATION OF DIISOPROPENYLBENZENE THE GOODYEAR TIRE & RUBBER COMPANY (US) 1986-10-08 EP disclosed
EP-0102912-A1 A process for the purification of diisopropenylbenzene THE GOODYEAR TIRE & RUBBER COMPANY (US) 1984-03-14 EP disclosed
US-4390741-A HYDROGENATION WITH PHODIUM CATALYST, DISTILLATION THE GOODYEAR TIRE & RUBBER COMPANY (US) 1983-06-28 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