SCHEMBL20768675

SCHEMBL20768675

CCCCCCOC(=O)C1CCCCC1(C(=O)OCCCCCC)C1(C(=O)OC2CCCCC2)CCCCC1C(=O)OC1CCCCC1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 3/20 0.43
MAPK1 P28482 2/20 0.35
HTT P42858 2/20 0.35
GAA P10253 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
CYP3A4 P08684 2/20 0.33
EPHX2 P34913 2/20 0.33
ABCB11 O95342 1/20 0.33
LMNA P02545 1/20 0.33
CYP1A2 P05177 1/20 0.33
CHRM2 P08172 1/20 0.33
CHRM4 P08173 1/20 0.33
CHRM5 P08912 1/20 0.33
CYP2D6 P10635 1/20 0.33
CHRM1 P11229 1/20 0.33
CYP2C9 P11712 1/20 0.33
TSHR P16473 1/20 0.33
CHRM3 P20309 1/20 0.33
DRD1 P21728 1/20 0.33
HRH2 P25021 1/20 0.33

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
SCHEMBL11229711 0.76 NAAA (0.38) NAAAMAPK1HTTGAASMN1; SMN2
SCHEMBL11225142 0.76 NAAA (0.38) NAAAMAPK1HTTGAASMN1; SMN2
SCHEMBL11225149 0.76 NAAA (0.38) NAAAMAPK1HTTGAASMN1; SMN2
SCHEMBL27646360 0.76 NAAA (0.39) NAAAMAPK1HTTGAASMN1; SMN2
SCHEMBL27646452 0.74 NAAA (0.39) NAAAMAPK1HTTCYP3A4ABCB11
SCHEMBL1296571 0.74 NAAA (0.55) NAAAMAPK1HTTGAASMN1; SMN2
SCHEMBL1297022 0.74 NAAA (0.55) NAAAMAPK1HTTGAASMN1; SMN2
SCHEMBL1296594 0.74 NAAA (0.55) NAAAMAPK1HTTGAASMN1; SMN2
SCHEMBL1296610 0.74 NAAA (0.55) NAAAMAPK1HTTGAASMN1; SMN2
SCHEMBL1297654 0.74 NAAA (0.55) NAAAMAPK1HTTGAASMN1; SMN2

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
US-11059779-B2 Storage stable aqueous organic peroxide emulsions NOURYON CHEMICALS INTERNATIONAL B.V. (NL) 2021-07-13 US disclosed
US-20190071397-A1 STORAGE STABLE AQUEOUS ORGANIC PEROXIDE EMULSIONS NOURYON CHEMICALS INTERNATIONAL B.V. (NL) 2019-03-07 US disclosed