SCHEMBL29133995

SCHEMBL29133995

CC/C=C\C/C=C\C/C=C\CCCCCCCCOC(CCCCCCCC/C=C\C/C=C\C/C=C\CC)C(O)CO

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.51
CNR1 P21554 1/20 0.51
CNR2 P34972 1/20 0.51
F7 P08709 2/20 0.41
F3 P13726 2/20 0.41
MAPT P10636 2/20 0.41
CYP19A1 P11511 2/20 0.41
CYP3A4 P08684 2/20 0.41
ALOX15 P16050 2/20 0.41
HSD17B10 Q99714 2/20 0.41
TDP1 Q9NUW8 2/20 0.41
OXER1 Q8TDS5 1/20 0.41
KDM4E B2RXH2 1/20 0.41
MEN1 O00255 1/20 0.41
FFAR1 O14842 1/20 0.41
NR1I2 O75469 1/20 0.41
LMNA P02545 1/20 0.41
PLA2G1B P04054 1/20 0.41
HPGD P15428 1/20 0.41
PTGS1 P23219 1/20 0.41

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
SCHEMBL16208869 0.92 ALDH1A1 (0.62) ALDH1A1CNR1CNR2
Ethylene Glycol SCHEMBL26618260 0.90 ALDH1A1 (0.61) ALDH1A1CNR1CNR2
SCHEMBL3892979 0.90 ALDH1A1 (0.64) ALDH1A1CNR1CNR2
SCHEMBL7591414 0.87 ALDH1A1 (0.55) ALDH1A1CNR1CNR2MAPTALOX15
SCHEMBL1735177 0.87 ALDH1A1 (0.55) ALDH1A1CNR1CNR2MAPTALOX15
SCHEMBL7202735 0.87 ALDH1A1 (0.55) ALDH1A1CNR1CNR2MAPTALOX15
SCHEMBL28992552 0.87 ALDH1A1 (0.55) ALDH1A1CNR1CNR2MAPTALOX15
SCHEMBL16086048 0.87 ALDH1A1 (0.55) ALDH1A1CNR1CNR2MAPTALOX15
SCHEMBL28992543 0.87 ALDH1A1 (0.55) ALDH1A1CNR1CNR2MAPTALOX15
Ethylene Glycol SCHEMBL26618285 0.86 ALDH1A1 (0.54) ALDH1A1CNR1CNR2MAPTALOX15

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-117043343-A Nucleic acid vaccine for mutant coronaviruses 苏州艾博生物科技有限公司 2023-11-10 CN disclosed