SCHEMBL21486137

SCHEMBL21486137

CCC(=O)N(C)C(=O)N(C)C(C)=O

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.36
TDP1 Q9NUW8 2/20 0.36
CHRM2 P08172 2/20 0.33
CHRM4 P08173 2/20 0.33
CHRM5 P08912 2/20 0.33
CHRM1 P11229 2/20 0.33
CHRM3 P20309 2/20 0.33
LMNA P02545 1/20 0.31
HSD17B10 Q99714 1/20 0.31
FFAR3 O14843 1/20 0.30

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
SCHEMBL7865142 0.87
SCHEMBL221704 0.81 CHRM1 (0.38) ALDH1A1CHRM2CHRM4CHRM5CHRM1
SCHEMBL11413136 0.78 ALDH1A1 (0.41) ALDH1A1TDP1LMNAHSD17B10FFAR3
SCHEMBL12663476 0.75 LMNA (0.32) ALDH1A1TDP1LMNAFFAR3
SCHEMBL13966304 0.72
SCHEMBL20387812 0.71 SOAT1 (0.32)
SCHEMBL14608530 0.71
SCHEMBL10437648 0.70 ALDH1A1 (0.46) ALDH1A1TDP1CHRM2CHRM4CHRM5
SCHEMBL12957824 0.69 ALDH1A1 (0.37) ALDH1A1CHRM2CHRM4CHRM5CHRM1
SCHEMBL16683559 0.69 CHRM1 (0.43) ALDH1A1TDP1CHRM2CHRM4CHRM5

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
EP-2272490-B1 Stabilization of body-care and household products against degradation by UV radiation using merocyanine derivatives BASF SE (DE) 2019-10-16 EP disclosed