SCHEMBL11064259

SCHEMBL11064259

N#[N+]c1ccc2c([nH]c3ccccc32)c1OS(=O)(=O)C(F)(F)F

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 6/20 0.40
PIM3 Q86V86 2/20 0.38
MAPT P10636 3/20 0.37
JAK2 O60674 1/20 0.37
TP53 P04637 1/20 0.37
HTT P42858 1/20 0.37
KLK7 P49862 1/20 0.37
CDK4 P11802 4/20 0.36
CCND1 P24385 4/20 0.36
GABRP O00591 2/20 0.35
GABRD O14764 2/20 0.35
GABRA1 P14867 2/20 0.35
GABRB1 P18505 2/20 0.35
GABRG2 P18507 2/20 0.35
GABRB3 P28472 2/20 0.35
GABRA5 P31644 2/20 0.35
GABRA3 P34903 2/20 0.35
GABRA2 P47869 2/20 0.35
GABRB2 P47870 2/20 0.35
GABRA4 P48169 2/20 0.35

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
SCHEMBL29010543 0.78 KIF11 (0.40) KIF11PIM3MAPTJAK2TP53
SCHEMBL29895701 0.75 KIF11 (0.50) KIF11PIM3MAPTJAK2TP53
SCHEMBL2181837 0.75 KIF11 (0.50) KIF11PIM3MAPTJAK2TP53
SCHEMBL29940531 0.75 KIF11 (0.50) KIF11PIM3MAPTJAK2TP53
SCHEMBL31661008 0.72 DYRK1A (0.40) KIF11MAPTJAK2TP53HTT
SCHEMBL20135926 0.71 TDO2 (0.51) KIF11MAPTGABRPGABRDGABRA1
SCHEMBL15453693 0.71 KIF11 (0.63) KIF11MAPTCDK4CCND1MEN1
Sulfuric Acid SCHEMBL28215212 0.69 KIF11 (0.45) KIF11PIM3MAPTJAK2TP53
Sulfuric Acid SCHEMBL28215214 0.69 KIF11 (0.45) KIF11PIM3MAPTJAK2TP53
SCHEMBL9271477 0.67 KIF11 (0.53) KIF11PIM3MAPTJAK2TP53

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
US-4482489-A USEFUL IN DIAZOTYPE SYSTEMS AND AS LATENT POLYMERIZATION INITIATORS JAMES RIVER GRAPHICS, INC. (US) 1984-11-13 US claimed
US-4482489-A USEFUL IN DIAZOTYPE SYSTEMS AND AS LATENT POLYMERIZATION INITIATORS JAMES RIVER GRAPHICS, INC. (US) 1984-11-13 US disclosed