SCHEMBL4097060

SCHEMBL4097060

CN(C(=N)N)n1ccnc1

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
NFKB1 P19838 1/20 0.33
QPCT Q16769 1/20 0.33
HSD17B10 Q99714 1/20 0.33
QPCTL Q9NXS2 1/20 0.33
HTT P42858 1/20 0.33

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
SCHEMBL28218901 0.80 HTT (0.37) NFKB1QPCTHSD17B10QPCTLHTT
SCHEMBL4261451 0.78 HTT (0.32) NFKB1QPCTHSD17B10QPCTLHTT
SCHEMBL4089017 0.77 CYP19A1 (0.31) NFKB1QPCTHSD17B10QPCTL
SCHEMBL3915551 0.74
SCHEMBL4106428 0.73 GRIN2D (0.33)
SCHEMBL4262207 0.73
SCHEMBL10853269 0.72 TBXAS1 (0.32)
SCHEMBL3920835 0.72 HTR3E (0.31)
SCHEMBL4394208 0.71
SCHEMBL22367558 0.69 TSHR (0.42) QPCTHSD17B10QPCTLHTT

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