SCHEMBL21963936

SCHEMBL21963936

CN(C)c1ccc(/C=C/CC[n+]2ccccc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4A O75164 6/20 0.52
KDM2A Q9Y2K7 6/20 0.52
RELA Q04206 1/20 0.51
MEN1 O00255 5/20 0.50
KMT2A Q03164 5/20 0.50
MAPT P10636 3/20 0.50
GAA P10253 1/20 0.50
CASP1 P29466 1/20 0.50
BRCA1 P38398 1/20 0.50
CASP7 P55210 1/20 0.50
HBB P68871 1/20 0.50
NPC1 O15118 3/20 0.47
RAB9A P51151 3/20 0.47
ALDH1A1 P00352 3/20 0.47
HTT P42858 3/20 0.47
SMN1; SMN2 Q16637 3/20 0.47
STAT3 P40763 1/20 0.47
GFER P55789 2/20 0.46
LMNA P02545 2/20 0.46
ALPG P10696 1/20 0.46

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
SCHEMBL7053905 1.00 KDM4A (0.52) KDM4AKDM2ARELAMEN1KMT2A
Iodide SCHEMBL9109200 0.98 KDM4A (0.54) KDM4AKDM2ARELAMEN1KMT2A
SCHEMBL10380810 0.90 APP (0.53) KDM4AKDM2ARELAMEN1KMT2A
Iodide SCHEMBL23888751 0.83 RELA (0.53) KDM4AKDM2ARELAMEN1KMT2A
Iodide SCHEMBL23888749 0.83 RELA (0.53) KDM4AKDM2ARELAMEN1KMT2A
SCHEMBL14984144 0.78 KDM4A (0.73) KDM4AKDM2ARELAMEN1KMT2A
SCHEMBL14984138 0.75 KDM4A (0.79) KDM4AKDM2ARELAMEN1KMT2A
SCHEMBL13645407 0.75 KDM4A (0.84) KDM4AKDM2ARELAMEN1KMT2A
SCHEMBL25000571 0.74 APP (0.55) KDM4AKDM2ARELAMEN1KMT2A
Iodide SCHEMBL2778577 0.74 BCHE (0.51) KDM4AKDM2AMEN1KMT2AMAPT

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
WO-2020099616-A1 METHOD FOR MODIFYING THE APPEARANCE OF A REGION OF THE FACE OF A USER, SAID REGION BEING COATED WITH A COSMETIC COMPOSITION L'OREAL (FR) 2020-05-22 WO disclosed