SCHEMBL10101865

SCHEMBL10101865

CC(=O)Nc1nc(N)nc(N)c1/N=N/c1c(C#N)cnn1-c1nccn1C

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 1/20 0.32
PTGS2 P35354 1/20 0.32
IRAK4 Q9NWZ3 1/20 0.31
XDH P47989 1/20 0.30

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
SCHEMBL12905196 0.69 KMT2A (0.34) XDH
SCHEMBL10101838 0.69 CDK2 (0.35) PTGS1PTGS2XDH
SCHEMBL10102099 0.69 CDK2 (0.35) PTGS1PTGS2XDH
SCHEMBL10101881 0.68 CHUK (0.36) IRAK4
SCHEMBL10101954 0.67 PLAUR (0.35) PTGS1PTGS2IRAK4
SCHEMBL10101862 0.67 MAPK8 (0.40) PTGS1PTGS2XDH
SCHEMBL10106723 0.67 KIT (0.33)
SCHEMBL4742164 0.65 PTGS1 (0.38) PTGS1PTGS2
SCHEMBL4742458 0.64 TSHR (0.44) PTGS1PTGS2
SCHEMBL10101894 0.64 PTGS1 (0.32) PTGS1PTGS2

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-8206465-B2 Azo pigments, pigment dispersion, coloring composition, and ink for inkjet recording FUJIFILM CORPORATION (JP) 2012-06-26 US disclosed
US-8206465-B2 Azo pigments, pigment dispersion, coloring composition, and ink for inkjet recording FUJIFILM CORPORATION (JP) 2012-06-26 US disclosed
US-20110011306-A1 AZO PIGMENTS, PIGMENT DISPERSION, COLORING COMPOSITION, AND INK FOR INKJET RECORDING FUJIFILM CORPORATION (JP) 2011-01-20 US disclosed
US-20110011306-A1 AZO PIGMENTS, PIGMENT DISPERSION, COLORING COMPOSITION, AND INK FOR INKJET RECORDING FUJIFILM CORPORATION (JP) 2011-01-20 US disclosed
EP-2253674-A1 AZO PIGMENT, PIGMENT DISPERSION, COLORING COMPOSITION, AND INKJET RECORDING INK FUJIFILM Corporation (JP) 2010-11-24 EP disclosed