SCHEMBL3983126

SCHEMBL3983126

CC(NC(=N)N)(C1CCCCC1)C1CCCCC1

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.37
ALDH1A1 P00352 1/20 0.37
LMNA P02545 1/20 0.37
ALOX12 P18054 1/20 0.37
KMT2A Q03164 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
NOS2 P35228 2/20 0.34
SSTR4 P31391 2/20 0.34
EPHX1 P07099 1/20 0.32

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
SCHEMBL3977832 0.78 NOS2 (0.37) MEN1ALDH1A1LMNAALOX12KMT2A
SCHEMBL3978855 0.76 NOS2 (0.39) MEN1ALDH1A1LMNAALOX12KMT2A
SCHEMBL25280113 0.74 MEN1 (0.35) MEN1ALDH1A1LMNAALOX12KMT2A
SCHEMBL687589 0.73 EPHX1 (0.39) MEN1ALDH1A1LMNAALOX12KMT2A
SCHEMBL1237553 0.71 NOS2 (0.39) MEN1ALDH1A1LMNAALOX12KMT2A
SCHEMBL7760502 0.71 DGAT1 (0.37) MEN1ALDH1A1LMNAALOX12KMT2A
SCHEMBL11316752 0.67 ALDH1A1 (0.38) MEN1ALDH1A1LMNAALOX12KMT2A
SCHEMBL11316747 0.67 ALDH1A1 (0.38) MEN1ALDH1A1LMNAALOX12KMT2A
SCHEMBL3141136 0.66 EPHX1 (0.35) SSTR4EPHX1
SCHEMBL3064939 0.66 NOS2 (0.42) MEN1ALDH1A1LMNAALOX12KMT2A

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