SCHEMBL6669031

SCHEMBL6669031

CCCOC(=O)CC(=O)CC

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FAAH O00519 2/20 0.50
NAAA Q02083 1/20 0.45
MGAM O43451 1/20 0.44
GAA P10253 1/20 0.44
SI P14410 1/20 0.44
MGAM2 Q2M2H8 1/20 0.44
TDP1 Q9NUW8 2/20 0.41
DGKA P23743 1/20 0.40
ALDH1A1 P00352 7/20 0.39
HCAR2 Q8TDS4 1/20 0.39
LMNA P02545 1/20 0.36
HTR2C P28335 1/20 0.36
EPHX2 P34913 1/20 0.36
ESR1 P03372 1/20 0.35
CHRM1 P11229 1/20 0.35
TSHR P16473 1/20 0.35
SLC6A2 P23975 1/20 0.35
KDR P35968 1/20 0.35
GLA P06280 2/20 0.35
KDM4E B2RXH2 1/20 0.35

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
SCHEMBL27940082 0.98 FAAH (0.48) FAAHNAAAMGAMGAASI
SCHEMBL8717357 0.90 FAAH (0.53) FAAHNAAAMGAMGAASI
SCHEMBL11738186 0.88 FAAH (0.42) FAAHNAAAMGAMGAASI
SCHEMBL29467312 0.86 FAAH (0.61) FAAHNAAATDP1DGKAALDH1A1
SCHEMBL648799 0.86 FAAH (0.61) FAAHNAAATDP1DGKAALDH1A1
SCHEMBL240282 0.85 MGAM (0.60) FAAHNAAAMGAMGAASI
SCHEMBL10603195 0.85 FAAH (0.70) FAAHNAAADGKAALDH1A1HTR2C
SCHEMBL27939809 0.85 FAAH (0.59) FAAHNAAATDP1DGKAALDH1A1
SCHEMBL20299505 0.84 FAAH (0.48) FAAHNAAAMGAMGAASI
SCHEMBL10646502 0.84 GAA (0.61) FAAHNAAAMGAMGAASI

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118638002-A Preparation method of sodium valproate toxic metabolite 2-propyl-4-pentenoic acid 湖南大学 2024-09-13 CN claimed
CN-116947600-B Preparation method of 2-isopropyl valeric acid as valproic acid process impurity 湖南省湘中制药有限公司 2024-04-26 CN claimed
CN-116874347-B Preparation method of impurity dipropylvaleric acid in valproic acid process 湖南省湘中制药有限公司 2024-03-29 CN claimed
CN-116947600-A Preparation method of 2-isopropyl valeric acid as valproic acid process impurity 湖南省湘中制药有限公司 2023-10-27 CN claimed
CN-116874347-A Preparation method of impurity dipropylvaleric acid in valproic acid process 湖南省湘中制药有限公司 2023-10-13 CN claimed
CN-107876092-B Application of titanium catalyst with cyclic structure as reaction catalyst for synthesizing benzyl carbonate or diphenyl carbonate by ester exchange 华东理工大学 2023-01-10 CN claimed
CN-107876092-A The high stability titanium catalyst of ester exchange carbonate synthesis benzene methyl and diphenyl carbonate 华东理工大学 2018-04-06 CN claimed
CN-107417719-A A kind of titanium chelate catalyst for being used for carbonate synthesis benzene methyl and diphenyl carbonate 华东理工大学 2017-12-01 CN claimed
CN-104744256-A Methods for preparing 2-(alkoxylalkylene)-3-oxocarboxylate and pyrimidine compound and application of iron used as catalyst BEIJING LAVIANA PHARMATECH CO LTD 2015-07-01 CN claimed
CN-118638002-A Preparation method of sodium valproate toxic metabolite 2-propyl-4-pentenoic acid 湖南大学 2024-09-13 CN disclosed
CN-116947600-B Preparation method of 2-isopropyl valeric acid as valproic acid process impurity 湖南省湘中制药有限公司 2024-04-26 CN disclosed
CN-116874347-B Preparation method of impurity dipropylvaleric acid in valproic acid process 湖南省湘中制药有限公司 2024-03-29 CN disclosed
CN-114901774-B Two-part curable polyurethane adhesive, cured product of two-part curable polyurethane adhesive, and polyurethane adhesive sheet 三洋化成工业株式会社 2023-11-03 CN disclosed
CN-116947600-A Preparation method of 2-isopropyl valeric acid as valproic acid process impurity 湖南省湘中制药有限公司 2023-10-27 CN disclosed
EP-0083690-B1 POLYAMIDE ACID COMPOSITION FOR PREPARING POLYIMIDE AND PROCESS FOR PREPARING POLYIMIDE FROM THE SAME KANEGAFUCHI KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1986-03-12 EP disclosed
US-4515915-A Polyamide acid composition for preparing polyimide KANEGAFUCHI KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1985-05-07 US disclosed
EP-0114059-A2 Method of preparing a polyamide acid composition for preparing polyimide KANEGAFUCHI KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1984-07-25 EP disclosed
US-4454276-A POT LIFE EXTENDING AGENT Kanegafuchi Chkagaku Kogyo Kabushiki Kaisha (JP) 1984-06-12 US disclosed
EP-0083690-A1 Polyamide acid composition for preparing polyimide and process for preparing polyimide from the same KANEGAFUCHI KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1983-07-20 EP disclosed
US-4046884-A N-(α-Aminoalkylidene)phosphor- and phosphonamidates, and method for controlling insects VELSICOL CHEMICAL CORPORATION (US) 1977-09-06 US disclosed