SCHEMBL28150485

SCHEMBL28150485

CC(=CBr)C(=O)OCCN(C)C

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 4/20 0.52
CHRM2 P08172 3/20 0.52
CHRM4 P08173 3/20 0.52
CHRM5 P08912 3/20 0.52
CHRM3 P20309 3/20 0.52
CHRNB2 P17787 1/20 0.52
CHRNA4 P43681 1/20 0.52
DNM1 Q05193 1/20 0.42
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA9 Q16790 1/20 0.41
BCHE P06276 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
PHLPP2 Q6ZVD8 1/20 0.40
NPSR1 Q6W5P4 1/20 0.37
ALDH1A1 P00352 3/20 0.36
MAPT P10636 2/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36

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
SCHEMBL340908 0.88 CHRM1 (0.52) CHRM1CHRM2CHRM4CHRM5CHRM3
Ammonia Solution, Strong SCHEMBL29221185 0.86 CHRM1 (0.50) CHRM1CHRM2CHRM4CHRM5CHRM3
Water SCHEMBL21326730 0.86 CHRM1 (0.50) CHRM1CHRM2CHRM4CHRM5CHRM3
SCHEMBL714694 0.85 CHRM1 (0.46) CHRM1CHRM2CHRM4CHRM5CHRM3
SCHEMBL5702357 0.84 CHRM1 (0.48) CHRM1CHRM2CHRM4CHRM5CHRM3
SCHEMBL28267149 0.84 CHRM1 (0.48) CHRM1CHRM2CHRM4CHRM5CHRM3
SCHEMBL28281070 0.84 CHRM1 (0.48) CHRM1CHRM2CHRM4CHRM5CHRM3
Hydrochloric Acid SCHEMBL28734137 0.84 CHRM1 (0.48) CHRM1CHRM2CHRM4CHRM5CHRM3
SCHEMBL5604794 0.82 CHRM1 (0.47) CHRM1CHRM2CHRM4CHRM5CHRM3
SCHEMBL27985333 0.82 CHRM1 (0.47) 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-106699577-A Preparation of novel antistatic functional monomer and application thereof in UV (ultraviolet) curing coating 湖南师范大学 2017-05-24 CN claimed
CN-109749064-A A kind of cationic antimicrobial polymer and preparation method thereof with self-degradation 广东工业大学 2019-05-14 CN disclosed