SCHEMBL545215

SCHEMBL545215

C=C(C)c1cccc(C(C)(C)OOC(C)(C)C)c1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.44
ALDH1A1 P00352 3/20 0.43
TSHR P16473 2/20 0.43
HTT P42858 2/20 0.43
MAPT P10636 2/20 0.43
LMNA P02545 1/20 0.43
MAPK1 P28482 1/20 0.42
KDM4E B2RXH2 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40

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
SCHEMBL1707006 0.95 L3MBTL1 (0.47) L3MBTL1ALDH1A1TSHRHTTMAPT
SCHEMBL30786391 0.86 ALDH1A1 (0.41) L3MBTL1ALDH1A1TSHRHTTMAPT
SCHEMBL9658863 0.84 L3MBTL1 (0.40) L3MBTL1ALDH1A1TSHRHTTMAPT
SCHEMBL16703328 0.84 SMN1; SMN2 (0.42) L3MBTL1ALDH1A1TSHRHTTMAPT
SCHEMBL1980073 0.83 KIF11 (0.43) ALDH1A1TSHRMAPTLMNAMAPK1
SCHEMBL9874577 0.83 ALDH1A1 (0.52) L3MBTL1ALDH1A1TSHRHTTMAPT
Hydrogen Peroxide SCHEMBL20240069 0.80 MAPK1 (0.60) ALDH1A1TSHRMAPTMAPK1CYP1A2
SCHEMBL44643 0.80 MAPK1 (0.58) ALDH1A1TSHRMAPK1
SCHEMBL9545770 0.79 MAPK1 (0.43) ALDH1A1TSHRMAPTMAPK1
SCHEMBL18408453 0.78 ACHE (0.55) L3MBTL1ALDH1A1TSHRHTTMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10875879-B2 Compositions, synthesis, and uses of hydrolyzable silane modified cashew nut shell liquid derivatives CARDOLITE CORPORATION (US) 2020-12-29 US claimed
US-20190077815-A1 COMPOSITIONS, SYNTHESIS, AND USES OF HYDROLYZABLE SILANE MODIFIED CASHEW NUT SHELL LIQUID DERIVATIVES CARDOLITE CORPORATION 2019-03-14 US claimed
CN-106588735-B A kind of production method of bis- (t-butylperoxyisopropyl) benzene 中国石油化工集团公司 2018-12-07 CN claimed
CN-106674732-A High-toughness and high-hardness polypropylene plastic 安徽省金正塑业有限公司 2017-05-17 CN claimed
CN-106588735-A Bis(t-butylperoxyisopropyl)benzene production method 中国石油化工集团公司 2017-04-26 CN claimed
CN-106521937-A Antistatic softener 无锡市华诚印染剂厂 2017-03-22 CN claimed
US-8110036-B2 Moisture curable oil and fat compositions and processes for preparing the same BOARD OF TRUSTEES OF MICHIGAN STATE UNIVERISTY (US) 2012-02-07 US claimed
US-7943685-B2 Composition and method for curing latex compounds R.T. VANDERBILT COMPANY, INC. (US) 2011-05-17 US claimed
EP-1869114-B1 METHOD FOR CURING LATEX COMPOUNDS VANDERBILT CO R T (US) 2010-05-26 EP claimed
WO-2010042175-A1 MOISTURE-CURABLE OIL AND FAT COMPOSITIONS AND PROCESSES FOR PREPARING THE SAME MICHIGAN STATE UNIVERSITY (US) 2010-04-15 WO claimed
US-20100083871-A1 Moisture-curable oil and fat compositions and processes for preparing the same BOARD OF TRUSTEES OF MICHIGAN STATE UNIVERSITY (US) 2010-04-08 US claimed
US-20060235126-A1 COMPOSITION AND METHOD FOR CURING LATEX COMPOUNDS R.T. VANDERBILT COMPANY, INC. (US) 2006-10-19 US claimed
US-6107407-A COPOLYMERIZATION OF AN ALKYL (METH)ACRYLATE AND A PEROXYUNSATURATED COMPOUND; DISSOLVING OR SWELLING IN A MONOMER, E.G. STYRENE, FORMING THE HARD GRAFT SHELL; POLYMERIZATION OF THE MIXTURE INCLUDING A REDUCING AGENT BASF AKTIENGESELLSCHAFT (DE) 2000-08-22 US claimed
EP-0904306-B1 process for preparing moulding compounds, modified by acrylic rubber, using groups introduced into said acrylic rubber, which groups are decomposed by a redox constituent to form radicals BASF AG (DE) 2000-05-10 EP claimed
US-5910553-A POLYMERIZING (METH)ACRYLATE AND A MONOMER WHICH FORMS FREE RADICALS UPON THERMAL DECOMPOSITION TO GIVE A RUBBER WHICH IS MIXED WITH A THIRD MONOMER, FREE RADICAL POLYMERIZATION; WEATHER RESISTANCE, IMPACT STRENGTH BASF AKTIENGESELLSCHAFT (DE) 1999-06-08 US claimed
EP-0904306-A1 PROCESS FOR PREPARING OF MOULDING COMPOUNDS, MODIFIED BY ACRYLIC RUBBER, USING GROUPS INTRODUCED INTO SAID ACRYLIC RUBBER, WHICH GROUPS ARE DECOMPOSED BY A REDOX CONSTITUENT TO FORM RADICALS BASF AKTIENGESELLSCHAFT (DE) 1999-03-31 EP claimed
EP-0792300-B1 PROCESS FOR PRODUCING MODIFIED RUBBER MOULDING MASSES BY USING PEROXY GROUP-CONTAINING COMPOUNDS BASF AG (DE) 1999-02-03 EP claimed
US-5837777-A CATALYTIC ADDITION POLMERIZATION OF ACRYLATE MONOMER, REACTION WITH OTHER MONOMERS FOR MOLDING MATERIALS BASF AKTIENGESELLSCHAFT (DE) 1998-11-17 US claimed
EP-0792298-B1 PROCESS FOR PRODUCING MODIFIED RUBBER MOULDING MASSES BY INCORPORATING GROUPS INTO THE RUBBER THAT FORM RADICALS BY THERMAL DECOMPOSITION BASF AG (DE) 1998-09-09 EP claimed
WO-1997047669-A1 PROCESS FOR PREPARING OF MOULDING COMPOUNDS, MODIFIED BY ACRYLIC RUBBER, USING GROUPS INTRODUCED INTO SAID ACRYLIC RUBBER, WHICH GROUPS ARE DECOMPOSED BY A REDOX CONSTITUENT TO FORM RADICALS BASF AKTIENGESELLSCHAFT (DE) 1997-12-18 WO claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20190077815-A1 COMPOSITIONS, SYNTHESIS, AND USES OF HYDROLYZABLE SILANE MODIFIED CASHEW NUT SHELL LIQUID DERIVATIVES NANS, SGMS1, FUT6 L3MBTL1 2194/4885ALDH1A1 2958/4885TSHR 4857/4885
US-10875879-B2 Compositions, synthesis, and uses of hydrolyzable silane modified cashew nut shell liquid derivatives NANS, SGMS1, FUT6 L3MBTL1 2194/4885ALDH1A1 2958/4885TSHR 4857/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.