SCHEMBL2743091

SCHEMBL2743091

Cc1cc(C)nc(-n2ncc(C#N)c2N)n1

nearest known ligand 0.62

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.56
MEN1 O00255 3/20 0.50
KDM4E B2RXH2 3/20 0.50
TSHR P16473 1/20 0.49
XDH P47989 2/20 0.46
ALDH1A1 P00352 3/20 0.44
NPSR1 Q6W5P4 1/20 0.44
HTT P42858 2/20 0.42
HPGD P15428 3/20 0.40
GLA P06280 2/20 0.40
MAPK1 P28482 1/20 0.40
HSD17B10 Q99714 1/20 0.40
MAPT P10636 2/20 0.39
RXFP1 Q9HBX9 1/20 0.38
PKM P14618 1/20 0.37

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
SCHEMBL13430463 0.91 KMT2A (0.51) KMT2AMEN1KDM4ETSHRXDH
SCHEMBL13430466 0.79 KMT2A (0.53) KMT2AMEN1KDM4EXDHALDH1A1
SCHEMBL3433147 0.77 KMT2A (0.73) KMT2AMEN1KDM4EXDHALDH1A1
SCHEMBL12998765 0.76 XDH (0.59) KMT2AMEN1KDM4ETSHRXDH
SCHEMBL13430469 0.74 KMT2A (0.44) KMT2AMEN1KDM4EXDHALDH1A1
SCHEMBL824637 0.74 KMT2A (0.54) KMT2AMEN1KDM4EXDHALDH1A1
SCHEMBL1456317 0.73 KMT2A (0.71) KMT2AMEN1KDM4ETSHRXDH
SCHEMBL12017340 0.72 KMT2A (0.53) KMT2AMEN1KDM4EXDHALDH1A1
SCHEMBL10616930 0.72 KMT2A (0.56) KMT2AMEN1KDM4EXDHALDH1A1
SCHEMBL1457396 0.72 KMT2A (0.62) KMT2AMEN1KDM4ETSHRXDH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8202327-B2 Pigment composition, inkjet recording ink, coloring composition for color filter, and color filter FUJIFILM CORPORATION (JP) 2012-06-19 US disclosed
US-8202327-B2 Pigment composition, inkjet recording ink, coloring composition for color filter, and color filter FUJIFILM CORPORATION (JP) 2012-06-19 US disclosed
US-20120001133-A1 PIGMENT COMPOSITION, INKJET RECORDING INK, COLORING COMPOSITION FOR COLOR FILTER, AND COLOR FILTER FUJIFILM CORPORATION (JP) 2012-01-05 US disclosed
US-20120001133-A1 PIGMENT COMPOSITION, INKJET RECORDING INK, COLORING COMPOSITION FOR COLOR FILTER, AND COLOR FILTER FUJIFILM CORPORATION (JP) 2012-01-05 US disclosed
EP-2402404-A1 Pigment composition, inkjet recording ink, coloring composition for color filter, and color filter FUJIFILM Corporation (JP) 2012-01-04 EP disclosed