SCHEMBL28906804

SCHEMBL28906804

CCCCC(=O)OC1CCC(O)CC1

nearest known ligand 0.64

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 2/20 0.64
SMN1; SMN2 Q16637 1/20 0.41
DGKA P23743 1/20 0.37
PRKCA P17252 5/20 0.37
ALDH1A1 P00352 2/20 0.37
HTT P42858 1/20 0.37
CES2 O00748 1/20 0.37
CES1 P23141 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
SCHEMBL8690279 0.92 NAAA (0.72) NAAASMN1; SMN2DGKAPRKCAALDH1A1
SCHEMBL28305046 0.89 NAAA (0.53) NAAASMN1; SMN2ALDH1A1HTT
SCHEMBL4978268 0.86 NAAA (0.82) NAAASMN1; SMN2DGKAPRKCA
SCHEMBL27754645 0.85 NAAA (0.64) NAAASMN1; SMN2DGKAPRKCAALDH1A1
SCHEMBL16046795 0.85 NAAA (0.86) NAAASMN1; SMN2DGKAPRKCA
SCHEMBL8691439 0.85 NAAA (0.79) NAAASMN1; SMN2DGKAPRKCAALDH1A1
SCHEMBL30915389 0.85 NAAA (0.86) NAAASMN1; SMN2DGKAPRKCA
SCHEMBL4978860 0.85 NAAA (0.86) NAAASMN1; SMN2DGKAPRKCAALDH1A1
SCHEMBL28454438 0.85 NAAA (0.86) NAAASMN1; SMN2DGKAPRKCA
SCHEMBL28110502 0.85 NAAA (0.86) NAAASMN1; SMN2DGKAPRKCA

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-112251240-B Quaternary ammonium salt ionic liquid crystal polymer with temperature control electronic switch performance and preparation method and application thereof 东北大学 2022-04-12 CN disclosed
CN-112251240-A Quaternary ammonium salt ionic liquid crystal polymer with temperature control electronic switch performance and preparation method and application thereof 东北大学 2021-01-22 CN disclosed