SCHEMBL28316152

SCHEMBL28316152

C=C(CCN)C(=O)OCCN(C)C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 2/20 0.46
CHRM2 P08172 1/20 0.46
CHRM4 P08173 1/20 0.46
CHRM5 P08912 1/20 0.46
CHRNB2 P17787 1/20 0.46
CHRM3 P20309 1/20 0.46
CHRNA4 P43681 1/20 0.46
DNM1 Q05193 1/20 0.41
PHLPP2 Q6ZVD8 1/20 0.39
CYP2C19 P33261 2/20 0.37
LMNA P02545 1/20 0.37
TSHR P16473 1/20 0.37
BCHE P06276 2/20 0.36
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA9 Q16790 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
NPSR1 Q6W5P4 1/20 0.33
ALDH1A1 P00352 2/20 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
SCHEMBL27545231 0.87 CHRM1 (0.50) CHRM1CHRM2CHRM4CHRM5CHRNB2
SCHEMBL5604791 0.84 DNM1 (0.50) CHRM1CHRM2CHRM4CHRM5CHRNB2
SCHEMBL28300534 0.82 CHRM1 (0.46) CHRM1CHRM2CHRM4CHRM5CHRNB2
SCHEMBL253219 0.82 CHRM1 (0.46) CHRM1CHRM2CHRM4CHRM5CHRNB2
SCHEMBL6811288 0.81 DNM1 (0.56) CHRM1CHRM2CHRM4CHRM5CHRNB2
SCHEMBL2951935 0.79 TSHR (0.40) CHRM1LMNATSHRSMN1; SMN2ALDH1A1
SCHEMBL1733667 0.79 CHRM2 (0.50) CHRM1CHRM2CHRM4CHRM5CHRNB2
SCHEMBL28316185 0.79 CHRM1 (0.43) CHRM1CHRM2CHRM4CHRM5CHRNB2
SCHEMBL28075193 0.79 CHRM1 (0.46) CHRM1CHRM2CHRM4CHRM5CHRNB2
SCHEMBL1605383 0.78 DNM1 (0.66) CHRM1CHRM2CHRM4CHRM5CHRNB2

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-110072818-A Make the method for the sludge dewatering from paper pulp, Paper or cardboard manufacturing process 凯米罗总公司 2019-07-30 CN claimed