SCHEMBL10101956

SCHEMBL10101956

CNc1cc(C)c(/N=N/c2c(C#N)cnn2-c2ncccn2)c(N2CCCC2)n1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 5/20 0.36
CASP1 P29466 5/20 0.36
CASP7 P55210 5/20 0.36
TSHR P16473 4/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
ALDH1A1 P00352 8/20 0.35
KDM4E B2RXH2 6/20 0.35
HSD17B10 Q99714 5/20 0.35
HPGD P15428 2/20 0.35
RECQL P46063 1/20 0.35
TDP1 Q9NUW8 3/20 0.35
LMNA P02545 1/20 0.35
MAPT P10636 3/20 0.34
NPSR1 Q6W5P4 2/20 0.34
USP2 O75604 1/20 0.34
POLB P06746 2/20 0.34
NPC1 O15118 1/20 0.34
PKM P14618 1/20 0.34
RAB9A P51151 1/20 0.34
HTT P42858 2/20 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
SCHEMBL10101841 0.85 NPC1 (0.30) NPC1RAB9A
SCHEMBL10101825 0.84 TSHR (0.33) ALOX15CASP1CASP7TSHRL3MBTL1
SCHEMBL10101913 0.83 ALDH1A1 (0.35) ALOX15CASP1CASP7TSHRL3MBTL1
SCHEMBL10101972 0.83 CNR2 (0.34) ALOX15CASP1CASP7TSHRL3MBTL1
SCHEMBL10101897 0.82 ALDH1A1 (0.35) ALOX15CASP1CASP7TSHRL3MBTL1
SCHEMBL10101969 0.81 ALDH1A1 (0.36) ALOX15CASP1CASP7TSHRL3MBTL1
SCHEMBL10106457 0.79 SMN1; SMN2 (0.33) TSHRALDH1A1TDP1LMNAMAPT
SCHEMBL10101832 0.77 NPC1 (0.30) NPC1RAB9A
SCHEMBL10101961 0.77 HTR3A (0.38) TSHRALDH1A1KDM4EHPGDMAPT
SCHEMBL10101889 0.76 MEN1 (0.38) TSHRALDH1A1KDM4EHSD17B10HPGD

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