SCHEMBL631293

SCHEMBL631293

C[N+](C)(C)C(CCO)C(=O)[O-]

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.47
ALPL P05186 1/20 0.47
ALPG P10696 1/20 0.47
BBOX1 O75936 2/20 0.40
SLC22A4 Q9H015 1/20 0.39
CYP3A4 P08684 2/20 0.36
TSHR P16473 2/20 0.36
NFKB1 P19838 2/20 0.36
NPSR1 Q6W5P4 2/20 0.36
GAA P10253 1/20 0.36
SLC22A16 Q86VW1 1/20 0.32
CA1 P00915 4/20 0.31
CPT2 P23786 1/20 0.30
CPT1A P50416 1/20 0.30
CA2 P00918 1/20 0.30

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
SCHEMBL5866870 0.86 POLB (0.44) POLBALPLALPGBBOX1SLC22A4
SCHEMBL6155809 0.81 POLB (0.47) POLBALPLALPGBBOX1SLC22A4
SCHEMBL109859 0.81 TSHR (0.52) POLBALPLALPGBBOX1SLC22A4
SCHEMBL14744262 0.78 GABRR1 (0.36) POLBALPLALPGBBOX1TSHR
SCHEMBL22479145 0.78 GABRR1 (0.36) POLBALPLALPGBBOX1TSHR
SCHEMBL1005600 0.77 POLB (0.48) POLBALPLALPGBBOX1SLC22A4
SCHEMBL17763259 0.77 CA2 (0.50) POLBALPLALPGBBOX1CYP3A4
SCHEMBL45428 0.77 POLB (0.44) POLBALPLALPGBBOX1SLC22A4
SCHEMBL16432634 0.77 POLB (0.44) POLBALPLALPGBBOX1SLC22A4
SCHEMBL4894577 0.76 CA1 (0.55) POLBALPLALPGCYP3A4TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112240173-B Foam circulation-based oil-gas well sand washing method, defoaming liquid for oil-gas well sand washing and foaming liquid 中国石油化工股份有限公司 2023-06-02 CN claimed
CN-112240173-A Oil and gas well sand washing and well flushing method based on foam circulation, and defoaming solution and foaming solution for oil and gas well sand washing and well flushing 中国石油化工股份有限公司 2021-01-19 CN claimed
WO-2024046834-A1 ANTIOXIDANT COMPOSITION COMPRISING 5-DEOXYFLAVONOIDS ANALYTICON DISCOVERY GMBH (DE) 2024-03-07 WO disclosed
WO-2023175129-A1 ADDITIVE FOR SUNSCREENS SYMRISE AG (DE) 2023-09-21 WO disclosed
US-20230202967-A1 COMPOSITIONS AND METHODS FOR TREATING ATHEROSCLEROTIC CARDIOVASCULAR DISEASE GAVISH-GALILEE BIO APPLICATIONS LTD. (IL) 2023-06-29 US disclosed
CN-112240173-B Foam circulation-based oil-gas well sand washing method, defoaming liquid for oil-gas well sand washing and foaming liquid 中国石油化工股份有限公司 2023-06-02 CN disclosed
CN-115466406-A PH-UCST response type lignin-based zwitterionic compound, preparation method thereof and method for recovering cellulase at room temperature 华南理工大学 2022-12-13 CN disclosed
WO-2022128052-A1 MEDICAMENT FOR FIGHTING INFLAMMATORY CONDITIONS OF HUMAN SKIN SYMRISE AG (DE) 2022-06-23 WO disclosed
WO-2022128054-A1 MEDICAMENT FOR FIGHTING INFLAMMATORY CONDITIONS OF HUMAN SKIN (IV) SYMRISE AG (DE) 2022-06-23 WO disclosed
CN-112240173-A Oil and gas well sand washing and well flushing method based on foam circulation, and defoaming solution and foaming solution for oil and gas well sand washing and well flushing 中国石油化工股份有限公司 2021-01-19 CN disclosed
CN-111621369-A Neutral environment-friendly water-based cleaning agent for high-end integrated circuit board and preparation method thereof 中山翰华锡业有限公司 2020-09-04 CN disclosed
CN-101790458-A Method for making a lithographic printing plate AGFA GRAPHICS NV 2010-07-28 CN disclosed
CN-101389476-B Method for making lithographic printing plate AGFA GRAPHICS NV 2010-06-23 CN disclosed
CN-101389476-A Method for making lithographic printing plate AGFA GRAPHICS NV (BE) 2009-03-18 CN disclosed
US-20080182960-A1 Surface-crosslinked latex particulates HEWLETT-PACKARD DEVELOPMENT COMPANY, L.P. 2008-07-31 US disclosed
CN-1930525-A Stable high pH developer KODAK POLYCHROME GRAPHICS GMBH (DE) 2007-03-14 CN disclosed
WO-2001039735-A1 CONDITIONING SHAMPOO COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 2001-06-07 WO disclosed
EP-0417559-A2 Silicone emulsions BAYER AG (DE) 1991-03-20 EP disclosed
EP-0079206-B1 PROCESS FOR PRODUCING 5-HALOMETHYLFURFURAL SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1986-02-19 EP disclosed
EP-0079206-A1 Process for producing 5-halomethylfurfural SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1983-05-18 EP 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-20230202967-A1 COMPOSITIONS AND METHODS FOR TREATING ATHEROSCLEROTIC CARDIOVASCULAR DISEASE DGAT2, DGAT1, LCAT POLB 1394/4885ALPL 1439/4885ALPG 2385/4885

“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.