SCHEMBL24901989

SCHEMBL24901989

CCCC(=O)NC1COC(CO)C(O)C1O

nearest known ligand 0.56

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ PYGB P11216 5/20 0.56
▸ GAA P10253 1/20 0.41
▸ TREH O43280 1/20 0.40
▸ TRPV1 Q8NER1 4/20 0.40
▸ CNR1 P21554 2/20 0.40
▸ CNR2 P34972 2/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.37

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
SCHEMBL14621061 1.00 PYGB (0.56) PYGBGAATREHTRPV1CNR1
SCHEMBL16274110 0.89 TRPV1 (0.56) PYGBTRPV1CNR1CNR2
SCHEMBL15504388 0.88 PYGB (0.54) PYGBGAATREH
SCHEMBL24239887 0.88 PYGB (0.54) PYGBGAATREH
SCHEMBL23425788 0.85 TREH (0.40) PYGBGAATREHTRPV1CNR1
SCHEMBL23315860 0.85 TREH (0.40) PYGBGAATREHTRPV1CNR1
SCHEMBL18391236 0.84 TREH (0.43) PYGBGAATREH
SCHEMBL21137909 0.82 PYGB (0.41) PYGBTRPV1CNR1CNR2L3MBTL1
SCHEMBL181348 0.81 TREH (0.42) PYGBGAATREH
SCHEMBL14653765 0.81 TREH (0.42) PYGBGAATREH

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
WO-2023001286-A1 POLYOL-MODIFIED LIPID COMPOUND AND PREPARATION METHOD AND APPLICATION THEREOF 天津键凯科技有限公司 2023-01-26 — — WO disclosed
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