SCHEMBL11259415

SCHEMBL11259415

N=C1NC(=O)c2c(Cl)cccc21

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES1 P23141 4/20 0.47
NSD2 O96028 1/20 0.47
BCHE P06276 1/20 0.47
DAO P14920 1/20 0.47
GSK3B P49841 4/20 0.41
STK10 O94804 4/20 0.41
SLK Q9H2G2 4/20 0.41
RET P07949 1/20 0.41
GRK5 P34947 1/20 0.41
TYRO3 Q06418 1/20 0.41
DYRK1B Q9Y463 1/20 0.41
CHEK1 O14757 3/20 0.40
WEE1 P30291 3/20 0.40
TGM2 P21980 3/20 0.37
GABRP O00591 1/20 0.37
GABRD O14764 1/20 0.37
GABRA1 P14867 1/20 0.37
GABRB1 P18505 1/20 0.37
GABRG2 P18507 1/20 0.37
GABRB3 P28472 1/20 0.37

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
SCHEMBL11260054 0.85 CES1 (0.47) CES1NSD2BCHEDAOGSK3B
SCHEMBL261439 0.82 GSK3B (0.52) CES1NSD2BCHEDAOGSK3B
SCHEMBL7828007 0.82 CES1 (0.38) CES1NSD2BCHEDAOGSK3B
Phthalimide SCHEMBL1501259 0.78 GSK3B (0.60) CES1NSD2BCHEDAOGSK3B
SCHEMBL3988383 0.77 ADORA2A (0.46) GSK3BCHEK1WEE1
SCHEMBL11222151 0.75 CES1 (0.47) CES1NSD2BCHEDAORET
Biphenyl SCHEMBL20954045 0.73 GSK3B (0.52) CES1NSD2BCHEDAOGSK3B
SCHEMBL11669701 0.72 S100A4 (0.56) GSK3BCHEK1WEE1
SCHEMBL30823795 0.71 DAO (0.39) CES1NSD2BCHEDAOGSK3B
SCHEMBL29497778 0.70 GSK3B (0.67) CES1BCHEGSK3BDYRK1B

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
US-4317929-A Tetraphenylketazines and isoindolinone pigments obtained therefrom CIBA-GEIGY CORPORATION (US) 1982-03-02 US disclosed
US-4231931-A YELLOW TO RED HUES CIBA-GEIGY CORPORATION (US) 1980-11-04 US disclosed
US-4065462-A ORGANIC PIGMENTS CIBA-GEIGY CORPORATION (US) 1977-12-27 US disclosed
US-4016157-A COLORING PLASTICS AND LACQUERS CIBA-GEIGY CORPORATION (US) 1977-04-05 US disclosed