SCHEMBL28877258

SCHEMBL28877258

CN(C)c1cccc(NC(N)=O)c1.NC(=O)Nc1cccc(N)c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.57
DDX3X O00571 2/20 0.56
SMN1; SMN2 Q16637 3/20 0.51
MAPT P10636 2/20 0.51
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
GAA P10253 1/20 0.50
ALOX15 P16050 1/20 0.50
MAPK1 P28482 1/20 0.49
BTK Q06187 1/20 0.47
BCHE P06276 1/20 0.46
ACHE P22303 1/20 0.46
HIF1A Q16665 1/20 0.45
KCNK3 O14649 1/20 0.44
HDAC3 O15379 1/20 0.44
HDAC4 P56524 1/20 0.44
HDAC1 Q13547 1/20 0.44
HDAC7 Q8WUI4 1/20 0.44
HDAC2 Q92769 1/20 0.44
HDAC10 Q969S8 1/20 0.44

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
SCHEMBL29356607 0.92 MAPT (0.57) ALDH1A1SMN1; SMN2MAPTMEN1KMT2A
SCHEMBL33898 0.92 MAPT (0.57) ALDH1A1SMN1; SMN2MAPTMEN1KMT2A
SCHEMBL18311610 0.89 DDX3X (0.72) ALDH1A1DDX3XSMN1; SMN2MAPTMEN1
SCHEMBL29521756 0.85 DDX3X (0.74) ALDH1A1DDX3XSMN1; SMN2MAPTMEN1
SCHEMBL33716 0.85 DDX3X (0.74) ALDH1A1DDX3XSMN1; SMN2MAPTMEN1
SCHEMBL29479571 0.84 DDX3X (0.71) ALDH1A1DDX3XSMN1; SMN2MAPTMEN1
Hydrochloric Acid SCHEMBL30440613 0.84 DDX3X (0.71) ALDH1A1DDX3XSMN1; SMN2MAPTMEN1
Hydrochloric Acid SCHEMBL8843870 0.84 DDX3X (0.71) ALDH1A1DDX3XSMN1; SMN2MAPTMEN1
SCHEMBL6782639 0.82 BTK (0.64) ALDH1A1DDX3XSMN1; SMN2MAPTALOX15
SCHEMBL27507634 0.80 MAPT (0.55) ALDH1A1SMN1; SMN2MAPTMEN1KMT2A

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116322633-A Hair care composition comprising polymeric colorant 美利肯公司 2023-06-23 CN disclosed
CN-116113397-A Oxidative hair cream compositions comprising polymeric colorants 美利肯公司 2023-05-12 CN disclosed
CN-116056682-A Oxidative hair cream compositions containing thiophene azo colorants 美利肯公司 2023-05-02 CN disclosed
CN-115279331-A Composition for imparting color and tone to hair 欧莱雅 2022-11-01 CN disclosed