SCHEMBL27985333

SCHEMBL27985333

CC(=CCBr)C(=O)OCCN(C)C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 4/20 0.47
CHRM2 P08172 3/20 0.47
CHRM4 P08173 3/20 0.47
CHRM5 P08912 3/20 0.47
CHRM3 P20309 3/20 0.47
CHRNB2 P17787 1/20 0.47
CHRNA4 P43681 1/20 0.47
DNM1 Q05193 1/20 0.39
BCHE P06276 2/20 0.37
CA12 O43570 1/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
CA9 Q16790 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
PHLPP2 Q6ZVD8 1/20 0.37
NPSR1 Q6W5P4 1/20 0.34
ALDH1A1 P00352 3/20 0.33
MAPT P10636 2/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 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
SCHEMBL28289271 0.86 CHRM1 (0.44) CHRM1CHRM2CHRM4CHRM5CHRM3
SCHEMBL5604794 0.85 CHRM1 (0.47) CHRM1CHRM2CHRM4CHRM5CHRM3
Hydrochloric Acid SCHEMBL29268857 0.84 CHRM2 (0.46) CHRM1CHRM2CHRM4CHRM5CHRM3
SCHEMBL127393 0.84 CHRM1 (0.46) CHRM1CHRM2CHRM4CHRM5CHRM3
SCHEMBL714694 0.84 CHRM1 (0.46) CHRM1CHRM2CHRM4CHRM5CHRM3
SCHEMBL28150485 0.82 CHRM1 (0.52) CHRM1CHRM2CHRM4CHRM5CHRM3
SCHEMBL340908 0.82 CHRM1 (0.52) CHRM1CHRM2CHRM4CHRM5CHRM3
SCHEMBL28788342 0.82 CHRM1 (0.44) CHRM1CHRM2CHRM4CHRM5CHRM3
SCHEMBL28027536 0.82 CHRM2 (0.44) CHRM1CHRM2CHRM4CHRM5CHRM3
Ammonia Solution, Strong SCHEMBL28164385 0.82 CHRM1 (0.44) CHRM1CHRM2CHRM4CHRM5CHRM3

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-104099081-A Sand-carrying drag reducer for fracturing and preparation method thereof SUN ANSHUN 2014-10-15 CN claimed
CN-104099081-A Sand-carrying drag reducer for fracturing and preparation method thereof SUN ANSHUN 2014-10-15 CN disclosed