SCHEMBL10102037

SCHEMBL10102037

CNc1nc(Nc2ccc(C)cc2)c(C#N)c(C)c1/N=N/c1c(C#N)c(C)nn1-c1ncccn1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.36
RXFP1 Q9HBX9 1/20 0.36
ALDH1A1 P00352 6/20 0.35
KDM4E B2RXH2 6/20 0.35
LMNA P02545 1/20 0.35
DHODH Q02127 1/20 0.35
MAPT P10636 2/20 0.32
MEN1 O00255 1/20 0.32
POLB P06746 1/20 0.32
KMT2A Q03164 1/20 0.32
PDE4B Q07343 1/20 0.32
PDE4D Q08499 1/20 0.32
CDK2 P24941 2/20 0.31
CCNA2 P20248 1/20 0.31
CCNA1 P78396 1/20 0.31
TP53 P04637 1/20 0.31
HPGD P15428 3/20 0.31
HSD17B10 Q99714 2/20 0.31
NTRK1 P04629 1/20 0.31
PIM1 P11309 1/20 0.31

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
SCHEMBL10102033 0.94 DHODH (0.36) ALDH1A1KDM4EDHODHPDE4BPDE4D
SCHEMBL10102013 0.91 KDM4E (0.42) RXFP1ALDH1A1KDM4ELMNAMAPT
SCHEMBL10102001 0.86 CSNK2A1 (0.35) THRBRXFP1ALDH1A1KDM4ELMNA
SCHEMBL10102105 0.80 ALDH1A1 (0.38) RXFP1ALDH1A1MEN1KMT2A
SCHEMBL10102041 0.80 ALDH1A1 (0.38) RXFP1ALDH1A1MEN1KMT2A
SCHEMBL10101976 0.80 CDK4 (0.35) ALDH1A1KDM4ELMNAMAPTMEN1
SCHEMBL10102018 0.79 ALDH1A1 (0.31) ALDH1A1POLBHPGD
SCHEMBL10102031 0.79 THRB (0.36) THRBRXFP1ALDH1A1KDM4ELMNA
SCHEMBL10101989 0.78 HPGD (0.44) ALDH1A1KDM4ELMNAMAPTPOLB
SCHEMBL10101974 0.78 KDM4E (0.41) RXFP1ALDH1A1KDM4EMAPTMEN1

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 4 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