SCHEMBL5277463

SCHEMBL5277463

Cn1nnc(C#N)c1[N+](=O)[O-]

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.33
MAPT P10636 1/20 0.32
DPP4 P27487 1/20 0.31
CHEK1 O14757 1/20 0.30
DAPK3 O43293 1/20 0.30
GRK5 P34947 1/20 0.30
LIMK1 P53667 1/20 0.30

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
SCHEMBL5278205 0.78 LMNA (0.33) MAPT
SCHEMBL5282837 0.77
SCHEMBL5279050 0.77 MAPT (0.33) MAPT
SCHEMBL5282262 0.76 SLC9A1 (0.35) MAPT
SCHEMBL5281258 0.74 SLC9A1 (0.38) MAPT
SCHEMBL5282926 0.72 PKM (0.46) PKMMAPTCHEK1DAPK3GRK5
SCHEMBL5282060 0.72 PKM (0.37) PKMMAPTCHEK1DAPK3GRK5
SCHEMBL5282629 0.72 PKM (0.37) PKMMAPTCHEK1DAPK3GRK5
SCHEMBL5280938 0.71 PKM (0.36) PKMMAPTCHEK1DAPK3GRK5
SCHEMBL5275091 0.71 PKM (0.36) PKMMAPTCHEK1DAPK3GRK5

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
EP-1859781-A2 Brightening and/or colouring agent with triazoles Henkel Kommanditgesellschaft auf Aktien (DE) 2007-11-28 EP disclosed