SCHEMBL1572826

SCHEMBL1572826

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

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.42
SLC22A6 Q4U2R8 1/20 0.39
FFAR3 O14843 2/20 0.38
TDP1 Q9NUW8 1/20 0.38
CACNA2D1 P54289 2/20 0.37
CACNB3 P54284 1/20 0.37
CACNA1C Q13936 1/20 0.37
PGR P06401 1/20 0.37
ADRA1A P35348 1/20 0.37
HTR2B P41595 1/20 0.37
CACNA2D2 Q9NY47 1/20 0.37
GPR84 Q9NQS5 4/20 0.35
MAPT P10636 1/20 0.34
GABRR1 P24046 1/20 0.33
HDAC3 O15379 1/20 0.33
HDAC1 Q13547 1/20 0.33
HDAC2 Q92769 1/20 0.33
HDAC8 Q9BY41 1/20 0.33

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
SCHEMBL678102 0.86 SLC22A6 (0.45) SMN1; SMN2SLC22A6FFAR3TDP1GPR84
SCHEMBL5077882 0.86 SLC22A6 (0.45) SMN1; SMN2SLC22A6FFAR3TDP1GPR84
SCHEMBL5960145 0.86 SMN1; SMN2 (0.48) SMN1; SMN2SLC22A6FFAR3TDP1CACNA2D1
SCHEMBL27753421 0.83 SLC22A6 (0.43) SMN1; SMN2SLC22A6FFAR3TDP1GPR84
SCHEMBL27945267 0.83 SLC22A6 (0.43) SMN1; SMN2SLC22A6FFAR3TDP1GPR84
SCHEMBL18222806 0.82 MME (0.39) SMN1; SMN2SLC22A6FFAR3TDP1CACNA2D1
SCHEMBL5078846 0.82 SLC22A6 (0.43) SMN1; SMN2SLC22A6FFAR3TDP1CACNA2D1
SCHEMBL10751531 0.80 TDP1 (0.40) SMN1; SMN2SLC22A6FFAR3TDP1CACNA2D1
SCHEMBL28599334 0.80 SLC22A6 (0.36) SMN1; SMN2SLC22A6FFAR3TDP1CACNA2D1
SCHEMBL5516785 0.80 HDAC1 (0.42) SMN1; SMN2SLC22A6FFAR3TDP1ADRA1A

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
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 claimed
EP-1747183-B1 METHOD OF PREPARING ALKOXYLATION CATALYSTS AND THEIR USE IN ALKOXYLATION PROCESSES HARCROS CHEMICALS INC (US) 2018-06-06 EP claimed
EP-4641061-A1 OIL-WELL METAL PIPE NIPPON STEEL CORPORATION (JP) 2025-10-29 EP disclosed
EP-4570255-A1 SPORICIDAL ANTIMICROBIAL COMPOSITIONS AND USES THEREOF Silva, Renata Moisés Iwamizu (BR) 2025-06-18 EP disclosed
WO-2024135464-A1 OIL-WELL METAL PIPE 日本製鉄株式会社 2024-06-27 WO disclosed
WO-2024031162-A1 SPORICIDAL ANTIMICROBIAL COMPOSITIONS AND USES THEREOF DA SILVA, Tasso Pereira (BR) 2024-02-15 WO disclosed
CN-112898128-B Synthesis method of russula rupestris ant pheromone component 3-ethyl-4-methylpentanol 苏州华道生物药业股份有限公司 2023-07-07 CN disclosed
US-20230212148-A1 THERAPEUTIC COMPOUNDS FOR HIV VIRUS INFECTION GILEAD SCIENCES, INC. 2023-07-06 US disclosed
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US 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
CN-112898128-A Method for synthesizing 3-ethyl-4-methylpentanol as pheromone component of limonum aureum 苏州华道生物药业股份有限公司 2021-06-04 CN disclosed
WO-2017027834-A1 MANGANESE-BASED CHELATE CONJUGATES FOR MOLECULAR MR IMAGING THE GENERAL HOSPITAL CORPORATION (US) 2017-02-16 WO disclosed
US-8026277-B2 Flavor composition or fragrance composition, product containing the flavor composition or fragrance composition, and novel ester compound TAKASAGO INTERNATIONAL CORPORATION (JP) 2011-09-27 US disclosed
EP-2098586-B1 FLAVOR COMPOSITION OR FRAGRANCE COMPOSITION, PRODUCT CONTAINING THE FLAVOR COMPOSITION OR FRAGRANCE COMPOSITION, AND NOVEL ESTER COMPOUND TAKASAGO PERFUMERY CO LTD (JP) 2011-04-13 EP disclosed
US-20100081725-A1 FLAVOR COMPOSITION OR FRAGRANCE COMPOSITION, PRODUCT CONTAINING THE FLAVOR COMPOSITION OR FRAGRANCE COMPOSITION, AND NOVEL ESTER COMPOUND TAKASAGO INTERNATIONAL CORPORATION (JP) 2010-04-01 US disclosed
EP-2098586-A1 FLAVOR COMPOSITION OR FRAGRANCE COMPOSITION, PRODUCT CONTAINING THE FLAVOR COMPOSITION OR FRAGRANCE COMPOSITION, AND NOVEL ESTER COMPOUND Takasago International Corporation (JP) 2009-09-09 EP disclosed
US-3932285-A MONOCARBOXYLIC ACID TENNECO CHEMICALS, INC. (US) 1976-01-13 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 (2 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-20100081725-A1 FLAVOR COMPOSITION OR FRAGRANCE COMPOSITION, PRODUCT CONTAINING THE FLAVOR COMPOSITION OR FRAGRANCE COMPOSITION, AND NOVEL ESTER COMPOUND MEP1A, NOTUM, MEP1B SMN1; SMN2 3363/4885SLC22A6 4428/4885FFAR3 306/4885
US-20230212148-A1 THERAPEUTIC COMPOUNDS FOR HIV VIRUS INFECTION CPSF6, NFATC1, CPSF1 SMN1; SMN2 3976/4885SLC22A6 449/4885FFAR3 2062/4885

“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.