SCHEMBL5044740

SCHEMBL5044740

CN(C)c1ccc(/N=N/c2ccc(N)cc2)c2ccccc12

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 8/20 0.64
KMT2A Q03164 8/20 0.64
TDP1 Q9NUW8 6/20 0.64
MAPT P10636 5/20 0.64
MAPK1 P28482 4/20 0.64
POLB P06746 1/20 0.64
NPC1 O15118 5/20 0.50
L3MBTL1 Q9Y468 3/20 0.50
CHEK1 O14757 1/20 0.50
NEK2 P51955 1/20 0.50
LIMK1 P53667 1/20 0.50
DYRK1A Q13627 1/20 0.50
CLK4 Q9HAZ1 1/20 0.50
RAB9A P51151 5/20 0.47
PKM P14618 1/20 0.47
HTT P42858 1/20 0.47
SMN1; SMN2 Q16637 2/20 0.44
INSR P06213 2/20 0.42
ALDH1A1 P00352 2/20 0.41
TSHR P16473 2/20 0.41

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
SCHEMBL5044742 1.00 MEN1 (0.64) MEN1KMT2ATDP1MAPTMAPK1
SCHEMBL3694623 0.92 MEN1 (0.73) MEN1KMT2ATDP1MAPTMAPK1
SCHEMBL14866828 0.86 MEN1 (0.66) MEN1KMT2ATDP1MAPTMAPK1
SCHEMBL14866951 0.84 KMT2A (0.64) MEN1KMT2ATDP1MAPTMAPK1
SCHEMBL5044106 0.83 EP300 (0.65) MEN1KMT2ATDP1MAPTMAPK1
SCHEMBL11589344 0.83 MEN1 (0.63) MEN1KMT2ATDP1MAPTMAPK1
SCHEMBL5044098 0.83 EP300 (0.65) MEN1KMT2ATDP1MAPTMAPK1
SCHEMBL12070545 0.82 CHEK1 (0.76) MEN1KMT2ATDP1MAPTMAPK1
SCHEMBL12070546 0.82 CHEK1 (0.76) MEN1KMT2ATDP1MAPTMAPK1
SCHEMBL14467528 0.81 MEN1 (0.76) MEN1KMT2ATDP1MAPTMAPK1

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7419620-B2 Dichroic mixtures ROLIC LTD C/O ROLIC TECHNOLOGIES LTD (CH) 2008-09-02 US disclosed
EP-1385914-B1 DICHROIC MIXTURE ROLIC AG (CH) 2008-07-23 EP disclosed
US-20040164272-A1 Dichoric mixture ROLIC AG (CH) 2004-08-26 US disclosed
EP-1385914-A1 DICHROIC MIXTURE Rolic AG (CH) 2004-02-04 EP disclosed
WO-2002090447-A1 DICHROIC MIXTURE ROLIC AG (CH) 2002-11-14 WO disclosed
EP-1256602-A1 Dichroic mixture Rolic AG (CH) 2002-11-13 EP disclosed