SCHEMBL28355454

SCHEMBL28355454

C=C(C)C(=O)C(C)[PH](=O)OCC[N+](C)(C)C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 7/20 0.40
CHRM3 P20309 7/20 0.40
CHRM5 P08912 6/20 0.40
CHRM2 P08172 6/20 0.40
CHRM4 P08173 6/20 0.40
CHRNB2 P17787 4/20 0.40
CHRNA4 P43681 4/20 0.40
CHRNA7 P36544 3/20 0.40
HTR1A P08908 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
ADRA2A P08913 1/20 0.40
ADRA1A P35348 1/20 0.40
PGR P06401 1/20 0.40
TBXA2R P21731 1/20 0.40
CHRNB4 P30926 1/20 0.40
CHRNA3 P32297 1/20 0.40
CHRNA10 Q9GZZ6 1/20 0.40
CHRNA9 Q9UGM1 1/20 0.40
GALR3 O60755 2/20 0.39
BLM P54132 2/20 0.39

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
SCHEMBL572696 0.80 CHRM1 (0.37) CHRM1CHRM3CHRM5CHRM2CHRM4
SCHEMBL28701633 0.76 CHRM5 (0.37) CHRM1CHRM3CHRM5CHRM2CHRM4
SCHEMBL28088686 0.75 CHRM5 (0.36) CHRM1CHRM3CHRM5CHRM2CHRM4
SCHEMBL3518545 0.75 THRB (0.43) CHRM1CHRM3CHRM5CHRM2CHRM4
SCHEMBL14739091 0.74 ADRA2A (0.43) CHRM1CHRM3CHRM5CHRM2CHRM4
SCHEMBL1025534 0.74 CHRM5 (0.44) CHRM1CHRM3CHRM5CHRM2CHRM4
SCHEMBL28553387 0.72 CHRM5 (0.42) CHRM1CHRM3CHRM5CHRM2CHRM4
Methacrylic Acid SCHEMBL22721392 0.72 CHRM5 (0.39) CHRM1CHRM3CHRM5CHRM2CHRM4
SCHEMBL2022215 0.71 CHRM5 (0.41) CHRM1CHRM3CHRM5CHRM2CHRM4
SCHEMBL28508063 0.71 CHRM1 (0.35) CHRM1CHRM3CHRM5CHRM2CHRM4

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-107106468-B Nanoemulsion emulsifying composition, bicontinuous microemulsion, cosmetic and preparation method thereof 日油株式会社 2020-02-14 CN disclosed