SCHEMBL29419952

SCHEMBL29419952

CCC(COC(=O)C(C)CN1CC1)(COC(=O)C(C)CN1CC1)COC(=O)C(C)CN1CC1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.38
PIK3CD O00329 1/20 0.37
CHRM2 P08172 2/20 0.34
ADRA2B P18089 2/20 0.34
DRD3 P35462 2/20 0.34
SIGMAR1 Q99720 2/20 0.34
HRH3 Q9Y5N1 2/20 0.34
LMNA P02545 2/20 0.34
KDM4E B2RXH2 2/20 0.34
CYP2D6 P10635 1/20 0.34
ADRA2C P18825 1/20 0.34
CHRM3 P20309 1/20 0.34
OPRD1 P41143 1/20 0.34
KCNH2 Q12809 1/20 0.34
POLB P06746 2/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C19 P33261 1/20 0.33
THRB P10828 1/20 0.33
GAA P10253 1/20 0.32
MC4R P32245 1/20 0.32

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
SCHEMBL22480293 0.89 ALDH1A1 (0.54) ALDH1A1LMNAKDM4ECYP3A4CYP2C19
SCHEMBL22480304 0.80 ALDH1A1 (0.45) ALDH1A1LMNAKDM4ECYP3A4CYP2C19
SCHEMBL22480296 0.80 ALDH1A1 (0.45) ALDH1A1LMNAKDM4ECYP3A4CYP2C19
SCHEMBL8218550 0.77 THRB (0.38) KDM4ETHRB
SCHEMBL9156940 0.75 THRB (0.34) ALDH1A1CHRM2LMNAKDM4ETHRB
SCHEMBL690291 0.74 THRB (0.36) THRB
SCHEMBL8208714 0.74 SMN1; SMN2 (0.39) ALDH1A1DRD3KDM4ECHRM3CYP3A4
SCHEMBL11570186 0.74 ALDH1A1 (0.47) ALDH1A1PIK3CDLMNAKDM4EPOLB
SCHEMBL13346798 0.73 THRB (0.40) ALDH1A1POLBCYP3A4THRB
SCHEMBL25322115 0.73 CHRM2 (0.49) ALDH1A1CHRM2ADRA2BDRD3SIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023095697-A1 PROTECTIVE SHEET, ELECTRONIC DEVICE PACKAGE, AND PRODUCTION METHOD THEREFOR 東洋インキSCホールディングス株式会社 2023-06-01 WO disclosed
CN-114249963-A Solvent-free curable composition, cured product, and method for producing same 东洋油墨SC控股株式会社 2022-03-29 CN disclosed