SCHEMBL28935992

SCHEMBL28935992

CC(=O)ON(C)CCCN(C)C

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.38
TSHR P16473 1/20 0.38
PAOX Q6QHF9 1/20 0.37
RAD52 P43351 1/20 0.37
CHRM2 P08172 1/20 0.35
CHRM4 P08173 1/20 0.35
CHRM5 P08912 1/20 0.35
CHRM1 P11229 1/20 0.35
CHRNB2 P17787 1/20 0.35
CHRM3 P20309 1/20 0.35
CHRNA4 P43681 1/20 0.35
USP2 O75604 1/20 0.33
LMNA P02545 1/20 0.33
KDM4E B2RXH2 2/20 0.33
GAA P10253 1/20 0.33
KDM4A O75164 6/20 0.32
KDM4C Q9H3R0 6/20 0.32
DNM1 Q05193 2/20 0.32
KDM5A P29375 1/20 0.32
KDM7A Q6ZMT4 1/20 0.32

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
SCHEMBL8781867 0.80 ALDH1A1 (0.41) ALDH1A1KDM4CDNM1KDM5APHF8
SCHEMBL11324407 0.78 DNM1 (0.44) ALDH1A1TSHRKDM4CDNM1KDM5A
SCHEMBL11320198 0.78 DNM1 (0.44) ALDH1A1TSHRKDM4CDNM1KDM5A
SCHEMBL11323157 0.78 DNM1 (0.44) ALDH1A1TSHRKDM4CDNM1KDM5A
SCHEMBL4321071 0.78 DNM1 (0.44) ALDH1A1TSHRKDM4CDNM1KDM5A
SCHEMBL6669138 0.77 DNM1 (0.43) ALDH1A1TSHRKDM4CDNM1KDM5A
SCHEMBL3002127 0.74
SCHEMBL829692 0.73 PRMT3 (0.44) ALDH1A1KDM4AKDM4C
SCHEMBL31190462 0.71 DNM1 (0.60) TSHRLMNADNM1
SCHEMBL28351684 0.71 TSHR (0.51) ALDH1A1TSHRGAA

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-114195685-B Purification method of 2-acrylamido-2-methylpropanesulfonic acid 爱森集团 2024-02-06 CN disclosed
CN-114195685-A Purification method of 2-acrylamide-2-methylpropanesulfonic acid SPCM股份公司 2022-03-18 CN disclosed