SCHEMBL338835

SCHEMBL338835

Cc1ccc(Bc2ccc(C)cc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ACHE P22303 6/20 0.57
▸ TDP1 Q9NUW8 1/20 0.57
▸ ALDH1A1 P00352 4/20 0.42
▸ CA2 P00918 2/20 0.42
▸ CA1 P00915 1/20 0.42
▸ CA7 P43166 1/20 0.42
▸ CA9 Q16790 1/20 0.42
▸ TSHR P16473 3/20 0.39
▸ LMNA P02545 2/20 0.39
▸ ALOX12 P18054 1/20 0.39
▸ CYP2A6 P11509 2/20 0.36
▸ IDO1 P14902 1/20 0.36
▸ CES2 O00748 1/20 0.36
▸ CES1 P23141 1/20 0.36
▸ LPL P06858 1/20 0.36
▸ LIPG Q9Y5X9 1/20 0.36
▸ ORAI1 Q96D31 1/20 0.36
▸ ORAI2 Q96SN7 1/20 0.36
▸ ORAI3 Q9BRQ5 1/20 0.36
▸ TRPV6 Q9H1D0 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
SCHEMBL13002373 0.88 ACHE (0.44) ACHETDP1ALDH1A1CA2CA1
SCHEMBL18827728 0.88 ACHE (0.53) ACHETDP1ALDH1A1CA2CA1
SCHEMBL19734142 0.82 ACHE (0.40) ACHETDP1ALDH1A1LMNAIDO1
SCHEMBL6903114 0.76 — —
P-Xylene SCHEMBL771 0.76 — —
P-Xylene SCHEMBL11772917 0.76 ACHE (1.00) ACHETDP1ALDH1A1CA2CA1
P-Xylene SCHEMBL11770184 0.76 ACHE (1.00) ACHETDP1ALDH1A1CA2CA1
P-Xylene SCHEMBL460348 0.76 ACHE (1.00) ACHETDP1ALDH1A1CA2CA1
SCHEMBL10305267 0.71 ACHE (0.47) ACHETDP1ALDH1A1CA2CA1
P-Xylene SCHEMBL2294575 0.71 ACHE (0.89) ACHETDP1ALDH1A1CA2CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8097348-B2 Pi-conjugated organoboron polymers in thin-film organic electronic devices TDA RESEARCH, INC. (US) 2012-01-17 — — US claimed
US-11780961-B2 Organic metal-free catalysts with electrophilic and nucleophilic dual-functions, preparation methods of making the same, and uses thereof ZHEJIANG UNIVERSITY (CN) 2023-10-10 — — US disclosed
WO-2023182123-A1 RESIN COMPOSITION, PREPREG, RESIN SHEET, LAMINATED PLATE, METAL FOIL-CLAD LAMINATED PLATE, AND PRINTED WIRING BOARD 三菱瓦斯化学株式会社 2023-09-28 — — WO disclosed
WO-2023182122-A1 RESIN COMPOSITION, PREPREG, RESIN SHEET, LAMINATED SHEET, METAL FOIL-CLAD LAMINATED SHEET, AND PRINTED WIRING BOARD 三菱瓦斯化学株式会社 2023-09-28 — — WO disclosed
WO-2023074484-A1 RESIN COMPOSITION, PREPREG, RESIN SHEET, LAMINATED PLATE, METAL FOIL-CLAD LAMINATED PLATE, AND PRINTED WIRING BOARD 三菱瓦斯化学株式会社 2023-05-04 — — WO disclosed
WO-2023011488-A1 PHARMACEUTICAL COMBINATION AND USE THEREOF 苏州亚盛药业有限公司 2023-02-09 — — WO disclosed
EP-4094940-A1 RESIN COMPOSITION, RESIN SHEET, PREPREG, AND PRINTED WIRING BOARD MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2022-11-30 — — EP disclosed
US-20210363297-A1 ORGANIC METAL-FREE CATALYSTS WITH ELECTROPHILIC AND NUCLEOPHILIC DUAL-FUNCTIONS, PREPARATION METHODS OF MAKING THE SAME, AND USES THEREOF ZHEJIANG UNIVERSITY (CN) 2021-11-25 — — US disclosed
WO-2021149733-A1 RESIN COMPOSITION, RESIN SHEET, PREPREG, AND PRINTED WIRING BOARD 三菱瓦斯化学株式会社 2021-07-29 — — WO disclosed
US-20210229407-A1 Resin Composition, Prepreg, Metal Foil-Clad Laminate, Resin Sheet, and Printed Wiring Board MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2021-07-29 — — US disclosed
EP-2248818-A1 ORGANIC SEMICONDUCTOR MATERIAL Sumitomo Chemical Company, Limited (JP) 2010-11-10 — — EP disclosed
US-7569694-B2 Coumarin compound, material for light emitting device and organic electroluminescent device CHISSO CORPORATION (JP) 2009-08-04 — — US disclosed
US-7514507-B2 Comb-shaped epoxy resin and method for preparing comb-shaped epoxy resin DAINIPPON INK AND CHEMICALS, INC. (JP) 2009-04-07 — — US disclosed
US-7393598-B2 Light emitting molecules and organic light emitting devices including light emitting molecules HCF PARTNERS, L.P. (US) 2008-07-01 — — US disclosed
EP-1936610-A1 SUPPORT FOR MAGNETIC RECORDING MEDIUM, AND MAGNETIC RECORDING MEDIUM TORAY INDUSTRIES, INC. (JP) 2008-06-25 — — EP disclosed
US-20070225395-A1 Thermally stable cationic photocurable compositions WOLF JEAN-PIERRE 2007-09-27 — — US disclosed
US-20070176544-A1 Coumarin compound, material for light emitting device and organic electroluminescent device JNC CORPORATION (JP) 2007-08-02 — — US disclosed
US-20070142611-A1 Comb-shaped epoxy resin and method for preparing comb-shaped epoxy resin DAINIPPON INK AND CHEMICALS, INC. (JP) 2007-06-21 — — US disclosed
EP-0766704-A1 POLYMERIZATION PROCESS AND CATALYST SYSTEMS USEFUL THEREIN EXXON CHEMICAL PATENTS INC. (US) 1997-04-09 — — EP disclosed
WO-1996000246-A1 POLYMERIZATION PROCESS AND CATALYST SYSTEMS USEFUL THEREIN EXXON CHEMICAL PATENTS INC. (US) 1996-01-04 — — WO disclosed

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

For each of this compound's patents that has machine-readable text (3 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-11780961-B2 Organic metal-free catalysts with electrophilic and nucleophilic dual-functions, preparation methods of making the same, and uses thereof DUOX1, SOD1, DUOX2 ACHE 383/4885TDP1 3125/4885ALDH1A1 424/4885
US-20070176544-A1 Coumarin compound, material for light emitting device and organic electroluminescent device TRPA1, CYP3A4, UGT1A10 ACHE 444/4885TDP1 3594/4885ALDH1A1 148/4885
US-20210363297-A1 ORGANIC METAL-FREE CATALYSTS WITH ELECTROPHILIC AND NUCLEOPHILIC DUAL-FUNCTIONS, PREPARATION METHODS OF MAKING THE SAME, AND USES THEREOF DUOX1, SOD1, DUOX2 ACHE 383/4885TDP1 3125/4885ALDH1A1 424/4885

“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.

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