SCHEMBL4247967

SCHEMBL4247967

CCCCCC1=C(OC(C)=O)CCC1=O

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.40
TDP1 Q9NUW8 2/20 0.40
LMNA P02545 1/20 0.40
POLB P06746 1/20 0.40
RECQL P46063 1/20 0.40
HIF1A Q16665 1/20 0.40
ALOX5 P09917 10/20 0.38
PPARG P37231 1/20 0.37
PPARA Q07869 1/20 0.37
CDC25A P30304 6/20 0.36
CDC25B P30305 6/20 0.36
CDC25C P30307 5/20 0.36
MAPT P10636 1/20 0.34
THRB P10828 1/20 0.34
MPEG1 Q2M385 5/20 0.33
XIAP P98170 1/20 0.33
GPR84 Q9NQS5 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
SCHEMBL9004869 0.86 NAAA (0.40) ALDH1A1TDP1LMNAPOLBRECQL
SCHEMBL2137246 0.80 ALDH1A1 (0.45) ALDH1A1TDP1ALOX5MAPTTHRB
SCHEMBL9004894 0.78 ALDH1A1 (0.39) ALDH1A1TDP1LMNAPOLBRECQL
SCHEMBL27488484 0.77 ALDH1A1 (0.36) ALDH1A1TDP1LMNAPOLBRECQL
SCHEMBL28484221 0.75 ALDH1A1 (0.42) ALDH1A1TDP1LMNAPOLBRECQL
SCHEMBL2142689 0.74 CYP1A2 (0.36) ALDH1A1TDP1ALOX5PPARGPPARA
Acetic Acid SCHEMBL9004863 0.73 ALDH1A1 (0.44) ALDH1A1TDP1LMNAPOLBRECQL
SCHEMBL18982985 0.72 SCD (0.41) ALDH1A1ALOX5PPARGPPARATHRB
SCHEMBL18982982 0.72 SCD (0.41) ALDH1A1ALOX5PPARGPPARATHRB
SCHEMBL8069818 0.72 ALOX5 (0.42) ALDH1A1TDP1LMNAPOLBRECQL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117586119-A Synthesis method of 3-oxo-2-amyl-cyclopentenyl methyl acetate 浙江新化化工股份有限公司 2024-02-23 CN claimed
EP-0583564-B1 Process for the preparation of 3-oxo-2-pentyl-1-cyclopentene alkyl acetates FIRMENICH & CIE (CH) 1996-10-09 EP claimed
EP-0583564-A1 Process for the preparation of 3-oxo-2-pentyl-1-cyclopentene alkyl acetates FIRMENICH SA (CH) 1994-02-23 EP claimed
CN-109134251-A A kind of preparation method of 3- oxo -2- amyl-cyclopentenyl methyl acetate 泛亚(武汉)食品科技有限公司 2019-01-04 CN disclosed
US-20090036692-A1 Process for Production of Substituted Cyclopentanone ASAHI KASEI CHEMICALS CORPORATION (JP) 2009-02-05 US disclosed
EP-2000455-A2 Process for production of substituted cyclopentanone Asahi Kasei Chemicals Corporation (JP) 2008-12-10 EP disclosed
EP-1900720-A1 PROCESS FOR PRODUCTION OF SUBSTITUTED CYCLOPENTANONE Asahi Kasei Chemicals Corporation (JP) 2008-03-19 EP disclosed
EP-0583564-B1 Process for the preparation of 3-oxo-2-pentyl-1-cyclopentene alkyl acetates FIRMENICH & CIE (CH) 1996-10-09 EP disclosed
EP-0583564-B1 Process for the preparation of 3-oxo-2-pentyl-1-cyclopentene alkyl acetates FIRMENICH & CIE (CH) 1996-10-09 EP disclosed
EP-0583564-A1 Process for the preparation of 3-oxo-2-pentyl-1-cyclopentene alkyl acetates FIRMENICH SA (CH) 1994-02-23 EP disclosed
EP-0583564-A1 Process for the preparation of 3-oxo-2-pentyl-1-cyclopentene alkyl acetates FIRMENICH SA (CH) 1994-02-23 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-20090036692-A1 Process for Production of Substituted Cyclopentanone COASY, POR, DHPS ALDH1A1 899/4885TDP1 4390/4885LMNA 4616/4885

“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.