SCHEMBL637402

SCHEMBL637402

CC(C)(C)OOC(=O)C(c1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNN4 O15554 3/20 0.60
ALDH1A1 P00352 2/20 0.56
TSHR P16473 1/20 0.56
HSD17B10 Q99714 1/20 0.56
TDP1 Q9NUW8 1/20 0.56
MAPK1 P28482 1/20 0.43
KMT2A Q03164 2/20 0.42
MAPT P10636 1/20 0.42
CYP2C19 P33261 1/20 0.41
HIF1A Q16665 1/20 0.41
ALOX15 P16050 1/20 0.41
MEN1 O00255 1/20 0.41
HDAC3 O15379 1/20 0.40
HDAC4 P56524 1/20 0.40
HDAC1 Q13547 1/20 0.40
HDAC7 Q8WUI4 1/20 0.40
HDAC2 Q92769 1/20 0.40
HDAC10 Q969S8 1/20 0.40
HDAC11 Q96DB2 1/20 0.40
HDAC8 Q9BY41 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
Hydrogen Peroxide SCHEMBL2813587 1.00 KCNN4 (0.60) KCNN4ALDH1A1TSHRHSD17B10TDP1
SCHEMBL11587108 0.85 ALDH1A1 (0.56) KCNN4ALDH1A1TSHRHSD17B10TDP1
SCHEMBL22471885 0.83 ALDH1A1 (0.55) KCNN4ALDH1A1TSHRHSD17B10TDP1
SCHEMBL491371 0.80 KCNN4 (0.64) KCNN4ALDH1A1TSHRHSD17B10TDP1
Hydrogen Peroxide SCHEMBL27880626 0.80 KCNN4 (0.64) KCNN4ALDH1A1TSHRHSD17B10TDP1
Water SCHEMBL27886592 0.78 KCNN4 (0.62) KCNN4ALDH1A1TSHRHSD17B10TDP1
Hydrogen Sulfide SCHEMBL27788757 0.78 KCNN4 (0.62) KCNN4ALDH1A1TSHRHSD17B10TDP1
Tert-Butyl Hydroperoxide SCHEMBL5908603 0.77 KCNN4 (0.60) KCNN4ALDH1A1TSHRHSD17B10TDP1
Triphenylacetic Acid Methyl Ester SCHEMBL7258414 0.75 KCNN4 (1.00) KCNN4ALDH1A1TSHRMAPK1KMT2A
SCHEMBL7587514 0.74 KCNN4 (0.68) KCNN4ALDH1A1KMT2AMAPTCYP2C19

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 17 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4618647-A TWO POLYMERIZATION CATALYSTS UNION CARBIDE CORP. (US) 1986-10-21 US claimed
CN-115145129-A Method for producing toner 佳能株式会社 2022-10-04 CN disclosed
CN-108873638-B Method for producing toner 佳能株式会社 2022-09-30 CN disclosed
CN-105278271-B Electrostatic image developing carrier, electrostatic image developer, developer cartridge, process cartridge, and image forming apparatus 富士施乐株式会社 2020-01-07 CN disclosed
US-10421828-B2 Resin composition for solid polymer fuel cell sealing material and solid polymer fuel cell sealing material using said resin composition PANAC CO., LTD. (JP) 2019-09-24 US disclosed
US-10310396-B2 Method of producing toner CANON KABUSHIKI KAISHA (JP) 2019-06-04 US disclosed
US-20180329322-A1 METHOD OF PRODUCING TONER CANON KABUSHIKI KAISHA (JP) 2018-11-15 US disclosed
CN-103324051-B Toner, developer, toner cartridge, developer box, handle box, image forming apparatus and image forming method 富士施乐株式会社 2018-06-26 CN disclosed
US-20170335026-A1 RESIN COMPOSITION FOR SOLID POLYMER FUEL CELL SEALING MATERIAL AND SOLID POLYMER FUEL CELL SEALING MATERIAL USING SAID RESIN COMPOSITION PANAC CO., LTD. (JP) 2017-11-23 US disclosed
US-8288493-B2 (meth)acrylic-modified siloxane compounds SHIN-ETSU CHEMICAL CO., LTD. (JP) 2012-10-16 US disclosed
EP-2112189-B1 (Meth)acrylic-modified siloxane compounds SHINETSU CHEMICAL CO (JP) 2012-02-22 EP disclosed
US-20090270529-A1 (METH)ACRYLIC-MODIFIED SILOXANE COMPOUNDS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2009-10-29 US disclosed
EP-2112189-A1 (Meth)acrylic-modified siloxane compounds Shin-Etsu Chemical Co., Ltd. (JP) 2009-10-28 EP disclosed
US-7364826-B2 Electrostatic latent image developing toner, and method for manufacturing electrostatic latent image developer and electrostatic latent image developing toner FUJI XEROX CO., LTD. (JP) 2008-04-29 US disclosed
US-20050181295-A1 Electrostatic latent image developing toner, and method for manufacturing electrostatic latent image developer and electrostatic latent image developing toner FUJI XEROX CO., LTD. (JP) 2005-08-18 US disclosed
US-4727110-A TWO-STAGE; POLYMER AS STABILIZER UNION CARBIDE CORPORATION (US) 1988-02-23 US disclosed
US-4618647-A TWO POLYMERIZATION CATALYSTS UNION CARBIDE CORP. (US) 1986-10-21 US 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 (1 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-20090270529-A1 (METH)ACRYLIC-MODIFIED SILOXANE COMPOUNDS MMAB, MGMT, PAM KCNN4 4380/4885ALDH1A1 388/4885TSHR 3729/4885

“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.