SCHEMBL27770562

SCHEMBL27770562

CCCCC(C)C(=O)OC(=O)CC

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CA1 P00915 4/20 0.45
NAAA Q02083 1/20 0.45
CA2 P00918 4/20 0.42
CYP3A4 P08684 2/20 0.42
TSHR P16473 1/20 0.42
ATM Q13315 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
MAPT P10636 1/20 0.39
FDPS P14324 1/20 0.39
LMNA P02545 2/20 0.38
MAPK1 P28482 1/20 0.38
ACE2 Q9BYF1 1/20 0.37
ALDH1A1 P00352 1/20 0.37
DGKA P23743 1/20 0.36

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
SCHEMBL1739770 0.89 CA1 (0.50) CA1NAAACA2CYP3A4TSHR
SCHEMBL28189025 0.88 ALDH1A1 (0.52) CA1NAAACA2CYP3A4TSHR
SCHEMBL14935428 0.87 NAAA (0.39) CA1NAAACA2CYP3A4TSHR
SCHEMBL1739771 0.86 LMNA (0.52) CA1CYP3A4TSHRATMTDP1
SCHEMBL15129310 0.85 CA1 (0.47) CA1NAAACA2CYP3A4TSHR
SCHEMBL22144882 0.85 CA1 (0.47) CA1NAAACA2CYP3A4TSHR
SCHEMBL27749470 0.85 LMNA (0.55) CYP3A4TSHRATMTDP1MAPT
SCHEMBL20838481 0.85 LMNA (0.55) CYP3A4TSHRATMTDP1MAPT
SCHEMBL29054983 0.83 CA2 (0.47) CA1CA2CYP3A4TSHRATM
SCHEMBL1865045 0.83 CA1 (0.45) CA1NAAACA2CYP3A4TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-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 disclosed
CN-111065448-B Method for producing gas separation membrane and gas separation membrane 株式会社LG化学 2022-07-19 CN disclosed
CN-111065448-A Method for producing composition for forming active layer of gas separation membrane, composition for forming active layer of gas separation membrane produced by the same, method for producing gas separation membrane, and gas separation membrane 株式会社LG化学 2020-04-24 CN disclosed
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 disclosed
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 disclosed
CN-101501078-A Process for preparing a catalyst component for the polymerization of olefins BASELL POLIOLEFINE SRL (IT) 2009-08-05 CN disclosed