SCHEMBL3977589

SCHEMBL3977589

CCCN(C(=N)N(n1cccn1)n1cccn1)n1cccn1

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
NOS1 P29475 2/20 0.31

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
SCHEMBL3985522 0.87 NOS1 (0.32) NOS1
SCHEMBL3920608 0.82 NOS1 (0.39) NOS1
SCHEMBL3919488 0.75 NOS1 (0.31) NOS1
SCHEMBL3919491 0.75 NOS1 (0.31) NOS1
SCHEMBL3982064 0.74
SCHEMBL3914658 0.71 NOS1 (0.41) NOS1
SCHEMBL14059429 0.71 NOS1 (0.34) NOS1
SCHEMBL3978406 0.70 NOS1 (0.32) NOS1
SCHEMBL3980444 0.68 GRIN2D (0.31)
SCHEMBL3986689 0.66

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
EP-2026754-A2 LIGHTENING AND/OR COLOURING AGENT COMPRISING CYCLIC UREA DERIVATIVES Henkel AG & Co. KGaA (DE) 2009-02-25 EP disclosed
WO-2007137676-A2 LIGHTENING AND/OR COLOURING AGENT COMPRISING CYCLIC UREA DERIVATIVES HENKEL AG & CO. KGAA (DE) 2007-12-06 WO disclosed