SCHEMBL28622302

SCHEMBL28622302

CCC(=O)OC1=CC=CC1.CCC(=O)OC1=CC=CC1

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 3/20 0.39
ESR1 P03372 2/20 0.39
RECQL P46063 1/20 0.39
KMT2A Q03164 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
ELANE P08246 1/20 0.36
ACHE P22303 3/20 0.34
ALOX15 P16050 1/20 0.34
ALDH1A1 P00352 1/20 0.32
CYP1A2 P05177 1/20 0.32
HPGD P15428 1/20 0.32
CYP2C19 P33261 1/20 0.32
BLM P54132 1/20 0.32
WRN Q14191 1/20 0.32
NAAA Q02083 1/20 0.31
FGFR1 P11362 1/20 0.31
HTT P42858 1/20 0.30

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
SCHEMBL28146878 0.83 HIF1A (0.36) HIF1AESR1RECQLKMT2ASMN1; SMN2
SCHEMBL9511578 0.79
SCHEMBL23780829 0.79
SCHEMBL8391841 0.79
SCHEMBL28366983 0.79
SCHEMBL3192528 0.77
SCHEMBL23780833 0.77
SCHEMBL5932084 0.77
SCHEMBL9768380 0.77
SCHEMBL5932233 0.75

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
CN-113260257-B Nano pesticide preparation and preparation method thereof 南京善思生物科技有限公司 2022-09-06 CN disclosed
CN-113260257-A Nano pesticide preparation and preparation method thereof 南京善思生物科技有限公司 2021-08-13 CN disclosed