SCHEMBL2717757

SCHEMBL2717757

CC(C)CC(C(=O)O)C(C)C

nearest known ligand 0.62

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SLC1A3 P43003 2/20 0.62
SLC1A2 P43004 2/20 0.62
SLC1A1 P43005 1/20 0.62
RNPEP Q9H4A4 1/20 0.50
SLC7A5 Q01650 1/20 0.50
ALDH1A1 P00352 2/20 0.43
CPA1 P15085 2/20 0.40
MEN1 O00255 1/20 0.40
LMNA P02545 1/20 0.40
KMT2A Q03164 1/20 0.40
TDP1 Q9NUW8 1/20 0.39
TP53 P04637 1/20 0.38
CACNA2D1 P54289 2/20 0.38
CACNB3 P54284 1/20 0.38
CACNA1C Q13936 1/20 0.38
PGR P06401 1/20 0.38
ADRA1A P35348 1/20 0.38
HTR2B P41595 1/20 0.38
CACNA2D2 Q9NY47 1/20 0.38

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
SCHEMBL2412183 0.88 RNPEP (0.55) SLC1A3SLC1A2SLC1A1RNPEPSLC7A5
SCHEMBL9677603 0.87 SLC1A3 (0.56) SLC1A3SLC1A2SLC1A1RNPEPSLC7A5
SCHEMBL9676557 0.85 SLC1A3 (0.54) SLC1A3SLC1A2SLC1A1RNPEPSLC7A5
SCHEMBL9675609 0.85 SLC1A3 (0.54) SLC1A3SLC1A2SLC1A1RNPEPSLC7A5
SCHEMBL9675574 0.85 SLC1A3 (0.54) SLC1A3SLC1A2SLC1A1RNPEPSLC7A5
SCHEMBL9675622 0.85 SLC1A3 (0.54) SLC1A3SLC1A2SLC1A1RNPEPSLC7A5
SCHEMBL6870066 0.83 SLC1A3 (0.62) SLC1A3SLC1A2SLC1A1RNPEPSLC7A5
SCHEMBL7384828 0.82 SLC1A3 (0.45) SLC1A3SLC1A2SLC1A1RNPEPSLC7A5
SCHEMBL2921465 0.82 SLC1A3 (0.45) SLC1A3SLC1A2SLC1A1RNPEPSLC7A5
SCHEMBL7453161 0.81 RNPEP (0.48) SLC1A3SLC1A2SLC1A1RNPEPSLC7A5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3088955-B1 RESIST COMPOSITION AND PATTERNING PROCESS SHINETSU CHEMICAL CO (JP) 2020-06-03 EP claimed
EP-3202876-B1 FIXED BED DECOLORIZATION PROCESS FOR UNSATURATED FATTY ACID ZHEJIANG MED XINCHANG PHARM (CN) 2019-07-31 EP claimed
EP-3032333-B1 SHRINK MATERIAL AND PATTERN FORMING PROCESS SHINETSU CHEMICAL CO (JP) 2017-05-24 EP claimed
EP-3032332-B1 SHRINK MATERIAL AND PATTERN FORMING PROCESS SHINETSU CHEMICAL CO (JP) 2017-04-05 EP claimed
EP-1853713-B1 Process for the isolation of polyhydroxyalkanoates (PHAs) from bacterial cells by solvent extraction PHB IND SA (BR) 2012-05-02 EP claimed
EP-3839028-B1 CLEANING PRODUCT PROCTER & GAMBLE (US) 2025-01-15 EP disclosed
EP-4386075-A2 CLEANING PRODUCT The Procter & Gamble Company (US) 2024-06-19 EP disclosed
US-20240108040-A1 HIGH INTENSITY SWEETENERS FIRMENICH INCORPORATED (US) 2024-04-04 US disclosed
US-11834627-B2 Cleaning product THE PROCTER & GAMBLE COMPANY (US) 2023-12-05 US disclosed
US-11834629-B2 Cleaning product THE PROCTER & GAMBLE COMPANY (US) 2023-12-05 US disclosed
EP-4124651-B1 CLEANING PRODUCT PROCTER & GAMBLE (US) 2023-11-29 EP disclosed
US-11779013-B2 Stabilized peroxyacid solutions EVONIK CORPORATION (US) 2023-10-10 US disclosed
US-20130225649-A1 COMPOUNDS FROM ANTRODIA CINNAMOMEA AND USE THEREOF SIMPSON BIOTECH CO., LTD. (TW) 2013-08-29 US disclosed
US-20130045165-A1 4-FLUORO-4-ARYLPIPERDIN-1-YL DERIVATIVES AS MU OPIOID FUNCTION MODERATORS KINENTIA BIOSCIENCES, LLC (US) 2013-02-21 US disclosed
US-8367666-B2 3-carbamoyl-2-pyridone derivatives SHIONOGI & CO., LTD. (JP) 2013-02-05 US disclosed
US-8367666-B2 3-carbamoyl-2-pyridone derivatives SHIONOGI & CO., LTD. (JP) 2013-02-05 US disclosed
US-8178681-B2 methyl 3-methyl-2-{[2-oxo-1-(2-oxo-ethyl)-1,2,5,6,7,8,9,10-octahydro-cycloocta[b]pyridine-3-carbonyl]-amino}-butyrate; cannabinoid receptor agonist; antiinflammatory agent, immunostimulant, analgesic; atopic dermatitis; excellent in photostability, and have excellent transdermal and oral absorbency SHIONOGI & CO., LTD. (JP) 2012-05-15 US disclosed
US-8178681-B2 methyl 3-methyl-2-{[2-oxo-1-(2-oxo-ethyl)-1,2,5,6,7,8,9,10-octahydro-cycloocta[b]pyridine-3-carbonyl]-amino}-butyrate; cannabinoid receptor agonist; antiinflammatory agent, immunostimulant, analgesic; atopic dermatitis; excellent in photostability, and have excellent transdermal and oral absorbency SHIONOGI & CO., LTD. (JP) 2012-05-15 US disclosed
US-20110230350-A1 ARYL-AND HETARYLSULFONAMIDES AS ACTIVE INGREDIENTS AGAINST ABIOTIC PLANT STRESS BAYER CROPSCIENCE AG (DE) 2011-09-22 US disclosed
US-20110230350-A1 ARYL-AND HETARYLSULFONAMIDES AS ACTIVE INGREDIENTS AGAINST ABIOTIC PLANT STRESS BAYER CROPSCIENCE AG (DE) 2011-09-22 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 (5 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-20240108040-A1 HIGH INTENSITY SWEETENERS TAS2R40, TAS2R60, TAS1R1 SLC1A3 480/4885SLC1A2 412/4885SLC1A1 502/4885
US-20130225649-A1 COMPOUNDS FROM ANTRODIA CINNAMOMEA AND USE THEREOF HAVCR2, CYP51A1, NPC1 SLC1A3 2657/4885SLC1A2 3693/4885SLC1A1 3281/4885
US-20110230350-A1 ARYL-AND HETARYLSULFONAMIDES AS ACTIVE INGREDIENTS AGAINST ABIOTIC PLANT STRESS STS, ARSA, TST SLC1A3 4334/4885SLC1A2 3431/4885SLC1A1 3793/4885
US-11779013-B2 Stabilized peroxyacid solutions PGD, ACMSD, ALAD SLC1A3 3310/4885SLC1A2 4001/4885SLC1A1 3695/4885
US-20130045165-A1 4-FLUORO-4-ARYLPIPERDIN-1-YL DERIVATIVES AS MU OPIOID FUNCTION MODERATORS OPRD1, OPRK1, OPRM1 SLC1A3 2205/4885SLC1A2 1305/4885SLC1A1 663/4885

“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.