SCHEMBL3627329

SCHEMBL3627329

CCC(C)C(C)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.50
TAAR1 Q96RJ0 4/20 0.44
TRPA1 O75762 2/20 0.44
AOC3 Q16853 2/20 0.42
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.41
MIF P14174 1/20 0.41
MME P08473 1/20 0.40
HKDC1 Q2TB90 1/20 0.39
HTR2A P28223 1/20 0.39
HRH1 P35367 1/20 0.39
CHRM2 P08172 1/20 0.39
CHRM4 P08173 1/20 0.39
CHRM1 P11229 1/20 0.39
CHRM3 P20309 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
SCHEMBL27679481 0.82 LMNA (0.43) LMNATAAR1TRPA1KMT2AMEN1
SCHEMBL27259898 0.82 RXRA (0.44) LMNATRPA1MMEHKDC1
SCHEMBL1293117 0.80 LMNA (0.50) LMNATAAR1TRPA1AOC3KMT2A
SCHEMBL9555071 0.78 TAAR1 (0.43) LMNATAAR1TRPA1AOC3HTR2A
SCHEMBL8127199 0.78 AOC3 (0.43) LMNATAAR1TRPA1AOC3HTR2A
SCHEMBL7537440 0.78 TAAR1 (0.43) LMNATAAR1TRPA1AOC3HTR2A
SCHEMBL17664825 0.78 TAAR1 (0.43) LMNATAAR1TRPA1AOC3HTR2A
SCHEMBL22009966 0.78 HKDC1 (0.52) LMNATAAR1TRPA1AOC3KMT2A
SCHEMBL5690126 0.78 TAAR1 (0.60) LMNATAAR1AOC3HTR2AHRH1
SCHEMBL10266421 0.78 AOC3 (0.43) LMNATAAR1TRPA1AOC3HTR2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5436402-A Reaction of o- or p-isobutylethylbenzene in the presence of a disproportionation acid catalyst and sec-butylethylbenzenne NIPPON PETROCHEMICALS CO., LTD. (JP) 1995-07-25 US claimed
EP-0373362-B1 METHOD FOR PREPARING P-ISOBUTYLSTYRENE NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1993-02-03 EP claimed
EP-0373362-A1 Method for preparing p-isobutylstyrene NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1990-06-20 EP claimed
JP-2256629-A None JP disclosed
US-7692046-B2 Heterogeneous arylalkyl oxidation promoter EXXONMOBIL CHEMICAL PATENTS INC. (US) 2010-04-06 US disclosed
US-20080319234-A1 Heterogeneous arylalkyl oxidation promoter EXXONMOBIL CHEMICAL PATENTS INC. 2008-12-25 US disclosed
CN-1216320-C Radiation sensitive refractivity change composition and method for changing refractivity JSR CORP (JP) 2005-08-24 CN disclosed
EP-1216993-B1 Process for preparing hydroperoxides MITSUI CHEMICALS INC (JP) 2005-05-11 EP disclosed
EP-1216992-B1 Process for preparing hydroperoxides MITSUI CHEMICALS INC (JP) 2005-04-20 EP disclosed
EP-0985649-B1 Method for producing an aromatic compound having an alkyl group with at least three carbon atoms TORAY INDUSTRIES (JP) 2004-11-24 EP disclosed
EP-1194375-B1 SYNTHETIC POROUS CRYSTALLINE MCM-68, ITS SYNTHESIS AND USE EXXONMOBIL OIL CORP (US) 2003-12-03 EP disclosed
US-5166419-A Multistage reaction by catalytic dehydrogenation and reaction with carbon monoxide NIPPON PETROCHEMICALS CO., LTD. (JP) 1992-11-24 US disclosed
US-5097061-A From isobutylbenzene and ethylene, dehydrogenation, carboxylation of the p-isobutylstyrene product, catalytic NIPPON PETROCHEMICALS CO., LTD. (JP) 1992-03-17 US disclosed
EP-0414207-A2 Method for preparing alpha-(-4-isobutylphenyl) propionic acid or its precursor NIPPON PETROCHEMICALS CO., LTD. (JP) 1991-02-27 EP disclosed
JP-H02256629-A PRODUCTION OF P-ISOBUTYLSTYRENE NIPPON PETROCHEM CO LTD 1990-10-17 JP disclosed
EP-0374850-A1 Method for preparing alpha-(4-isobutylphenyl)propionic acid or its precursor NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1990-06-27 EP disclosed
EP-0373362-A1 Method for preparing p-isobutylstyrene NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1990-06-20 EP disclosed
EP-0373362-A1 Method for preparing p-isobutylstyrene NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1990-06-20 EP disclosed
EP-0347939-A1 Method for preparing alpha-(4-isobutylphenyl) propionic acid or its precursor NIPPON PETROCHEMICALS CO., LTD. (JP) 1989-12-27 EP disclosed
US-4294588-A MORPHOLINE ADDITIVE AS ANTIAGGLOMERANT BETZ LABORATORIES, INC. (US) 1981-10-13 US disclosed