SCHEMBL28847646

SCHEMBL28847646

CCCCCCCC/C=C\CCCCCCCC(=O)C(O)(C(=O)CCCCCCC/C=C\CCCCCCCC)C(O)CO.NCC(N)P(=O)=O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FAAH O00519 7/20 0.45
CES1 P23141 2/20 0.45
SOAT1 P35610 2/20 0.43
CYP1A2 P05177 2/20 0.43
CYP2C19 P33261 2/20 0.43
KMT2A Q03164 2/20 0.43
MEN1 O00255 1/20 0.43
TP53 P04637 1/20 0.43
CYP3A4 P08684 1/20 0.43
DGKA P23743 1/20 0.42
KDM4E B2RXH2 2/20 0.40
DEGS1 O15121 1/20 0.40
TERT O14746 3/20 0.40
MAPT P10636 2/20 0.40
BLM P54132 2/20 0.40
HSD17B10 Q99714 2/20 0.40
FABP4 P15090 2/20 0.40
PTPN1 P18031 2/20 0.40
PPARG P37231 2/20 0.40
PPARD Q03181 2/20 0.40

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
SCHEMBL8343681 0.87 FAAH (0.58) FAAHCES1SOAT1CYP1A2CYP2C19
SCHEMBL19873069 0.87 FAAH (0.58) FAAHCES1SOAT1CYP1A2CYP2C19
SCHEMBL8343680 0.87 FAAH (0.58) FAAHCES1SOAT1CYP1A2CYP2C19
SCHEMBL8344665 0.87 FAAH (0.58) FAAHCES1SOAT1CYP1A2CYP2C19
SCHEMBL361243 0.87 FAAH (0.58) FAAHCES1SOAT1CYP1A2CYP2C19
SCHEMBL8344661 0.87 FAAH (0.58) FAAHCES1SOAT1CYP1A2CYP2C19
SCHEMBL170316 0.87 FAAH (0.58) FAAHCES1SOAT1CYP1A2CYP2C19
SCHEMBL2179345 0.87 FAAH (0.58) FAAHCES1SOAT1CYP1A2CYP2C19
Octane SCHEMBL16439984 0.87 FAAH (0.58) FAAHCES1SOAT1CYP1A2CYP2C19
SCHEMBL2179341 0.87 FAAH (0.58) FAAHCES1SOAT1CYP1A2CYP2C19

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-114404388-B Method for loading mRNA in vitro by extracellular vesicles 天津外泌体科技有限公司 2022-07-26 CN disclosed