SCHEMBL1998916

SCHEMBL1998916

CCCC(=O)OC(C)(C)CC

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.50
CES2 O00748 1/20 0.38
CES1 P23141 1/20 0.38
HDAC3 O15379 4/20 0.36
HDAC1 Q13547 4/20 0.36
HDAC2 Q92769 4/20 0.36
HDAC8 Q9BY41 4/20 0.36
FFAR3 O14843 3/20 0.36
TSHR P16473 3/20 0.36
TDP1 Q9NUW8 1/20 0.36
LMNA P02545 1/20 0.35
HDAC6 Q9UBN7 1/20 0.32
DGKA P23743 1/20 0.31
CTSD P07339 1/20 0.31
BCL9 O00512 1/20 0.31
CTNNB1 P35222 1/20 0.31

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
SCHEMBL142215 0.90 TSHR (0.39) ALDH1A1TSHRTDP1
SCHEMBL11509336 0.86 CES1 (0.42) ALDH1A1CES2CES1TSHRLMNA
SCHEMBL8162633 0.85 DGKA (0.50) ALDH1A1CES2CES1TSHRLMNA
SCHEMBL8011953 0.84 ALDH1A1 (0.35) ALDH1A1TSHRTDP1
SCHEMBL12083658 0.84 ALDH1A1 (0.35) ALDH1A1TSHRTDP1
SCHEMBL17882018 0.84 ALDH1A1 (0.48) ALDH1A1CES2CES1HDAC3HDAC1
SCHEMBL8157869 0.83 DGKA (0.53) ALDH1A1CES2CES1TSHRTDP1
SCHEMBL12481907 0.83 DGKA (0.53) ALDH1A1CES2CES1TSHRTDP1
SCHEMBL20918367 0.83 DGKA (0.53) ALDH1A1CES2CES1TSHRTDP1
SCHEMBL19809916 0.83 DGKA (0.53) ALDH1A1CES2CES1TSHRTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117304049-A Preparation method of N,2, 3-trimethyl-2-isopropyl butyramide cooling agent 江西亿森源植物香料有限公司 2023-12-29 CN claimed
CN-113905612-B Arthropod control composition 弗门尼舍有限公司 2025-04-08 CN disclosed
US-20240410055-A1 METHOD AND FORMULATION FOR PREPARING OPTICAL METAL OXIDE LAYERS MERCK PATENT GMBH (DE) 2024-12-12 US disclosed
CN-118076767-A Method and formulation for producing an optical metal oxide layer 默克专利有限公司 2024-05-24 CN disclosed
CN-117304049-A Preparation method of N,2, 3-trimethyl-2-isopropyl butyramide cooling agent 江西亿森源植物香料有限公司 2023-12-29 CN disclosed
US-11773266-B2 Polymer, molded body, foam, resin composition, and production method for polymer SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2023-10-03 US disclosed
US-20230129965-A1 HYDROPHILIC AND OLEOPHOBIC POLYMER SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2023-04-27 US disclosed
WO-2023057401-A1 METHOD AND FORMULATION FOR PREPARING OPTICAL METAL OXIDE LAYERS MERCK PATENT GMBH (DE) 2023-04-13 WO disclosed
CN-109952360-B Quantum dot dispersion, self-luminous photosensitive resin composition, color filter manufactured using the same, and image display device 东友精细化工有限公司 2022-03-22 CN disclosed
US-20180030175-A1 POLYMER SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2018-02-01 US disclosed
US-9176382-B2 Composition for forming titanium-containing resist underlayer film and patterning process SHIN-ETSU CHEMICAL CO., LTD. (JP) 2015-11-03 US disclosed
US-8992790-B2 Patterning process SHIN-ETSU CHEMICAL CO., LTD. (JP) 2015-03-31 US disclosed
US-20140273448-A1 COMPOSITION FOR FORMING TITANIUM-CONTAINING RESIST UNDERLAYER FILM AND PATTERNING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2014-09-18 US disclosed
US-8759220-B1 Patterning process SHIN-ETSU CHEMICAL CO., LTD. (JP) 2014-06-24 US disclosed
US-20130284699-A1 PATTERNING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2013-10-31 US disclosed
EP-2657767-A1 Patterning process Shin-Etsu Chemical Co., Ltd. (JP) 2013-10-30 EP disclosed
EP-2540780-A1 Composition for forming resist underlayer film and patterning process using the same Shin-Etsu Chemical Co., Ltd. (JP) 2013-01-02 EP disclosed
US-8288316-B2 N-(1,2,5-oxadiazol-3-yl)benzamides and their use as herbicides BAYER CROPSCIENCE AG (DE) 2012-10-16 US disclosed
US-20110152084-A1 N-(1,2,5-OXADIAZOL-3-YL)BENZAMIDES AND THEIR USE AS HERBICIDES BAYER CROPSCIENCE AG (DE) 2011-06-23 US disclosed
CN-101108849-A Benzo 58743 TOKUYAMA CORP (JP) 2008-01-23 CN 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-20110152084-A1 N-(1,2,5-OXADIAZOL-3-YL)BENZAMIDES AND THEIR USE AS HERBICIDES AOX1, CBR3, ZYX ALDH1A1 109/4885CES2 332/4885CES1 781/4885

“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.