SCHEMBL28375645

SCHEMBL28375645

CN(C)C(=O)C=Cc1ccccc1Br

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.65
LY96 Q9Y6Y9 1/20 0.54
BCHE P06276 1/20 0.51
ALOX5 P09917 1/20 0.45
KMT2A Q03164 3/20 0.45
MEN1 O00255 2/20 0.45
USP2 O75604 1/20 0.45
ATM Q13315 2/20 0.44
RELA Q04206 1/20 0.43
CCNC P24863 1/20 0.43
CDK8 P49336 1/20 0.43
NR4A2 P43354 1/20 0.41
MAPT P10636 3/20 0.41
LMNA P02545 2/20 0.41
ALDH1A1 P00352 1/20 0.40
HSP90AA1 P07900 1/20 0.40
IP6K1 Q92551 1/20 0.40
IP6K2 Q9UHH9 1/20 0.40
NFE2L2 Q16236 2/20 0.39
JUN P05412 1/20 0.39

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
SCHEMBL19954281 0.80 TRPM8 (0.48) ALOX5KMT2AMEN1CCNCCDK8
SCHEMBL3732406 0.80 TRPM8 (0.48) ALOX5KMT2AMEN1CCNCCDK8
SCHEMBL1782823 0.79 HSD11B1 (0.71) HSD11B1LY96BCHEKMT2AMEN1
SCHEMBL1782824 0.79 HSD11B1 (0.71) HSD11B1LY96BCHEKMT2AMEN1
SCHEMBL30963013 0.79 HSD11B1 (0.71) HSD11B1LY96BCHEKMT2AMEN1
SCHEMBL30317482 0.79 HSD11B1 (1.00) HSD11B1LY96BCHEKMT2AMEN1
SCHEMBL17973990 0.79 HSD11B1 (1.00) HSD11B1LY96BCHEKMT2AMEN1
SCHEMBL4105481 0.79 HDAC1 (0.57) KMT2AMEN1RELAMAPTLMNA
SCHEMBL20124823 0.77 ALOX5 (0.44) ALOX5CCNCCDK8NR4A2MAPT
SCHEMBL1049718 0.77 HSD11B1 (0.74) HSD11B1LY96BCHEKMT2AATM

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-111018735-B Preparation method of cinnamamide compound 河南农业大学 2021-09-07 CN disclosed
CN-111018735-A Preparation method of cinnamamide 河南农业大学 2020-04-17 CN disclosed