SCHEMBL28992178

SCHEMBL28992178

CCC(=O)OCCCCC1=CC=CC1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 2/20 0.49
HTT P42858 1/20 0.44
GAA P10253 1/20 0.36
ALDH1A1 P00352 2/20 0.34
CYP1A2 P05177 1/20 0.34
HPGD P15428 1/20 0.34
CYP2C19 P33261 1/20 0.34
BLM P54132 1/20 0.34
WRN Q14191 1/20 0.34
HIF1A Q16665 1/20 0.34
KDM4E B2RXH2 2/20 0.34
DGKA P23743 1/20 0.33
TSHR P16473 2/20 0.33
TP53 P04637 1/20 0.33
CYP3A4 P08684 1/20 0.33
MAPK1 P28482 1/20 0.33
RAD52 P43351 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
POLB P06746 1/20 0.32
FAAH O00519 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
SCHEMBL28992213 0.97 NAAA (0.49) NAAAHTTGAAALDH1A1CYP1A2
SCHEMBL28992200 0.90 NAAA (0.43) NAAAHTTGAAALDH1A1CYP1A2
SCHEMBL22184133 0.80 NPC1 (0.43) HTTALDH1A1KDM4EDGKATSHR
SCHEMBL28992199 0.77 DGKA (0.41) NAAAALDH1A1KDM4EDGKADNM1
SCHEMBL18725844 0.74
SCHEMBL11074782 0.74
SCHEMBL11563602 0.74
SCHEMBL50185 0.74 NAAA (0.81) NAAAHTTGAAALDH1A1DGKA
SCHEMBL20569200 0.73 CYP4F2 (0.47) GAAALDH1A1CYP1A2HPGDKDM4E
SCHEMBL13838043 0.73 TSHR (0.47) HTTALDH1A1HPGDTSHRLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110300791-B Quantum dot dispersion, self-luminous photosensitive resin composition, color filter, and image display device 东友精细化工有限公司 2023-03-31 CN disclosed