SCHEMBL10101923

SCHEMBL10101923

CNc1nc(C)c(/N=N/c2c(C#N)cnn2-c2ncccn2)c(N(C)C)n1

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
MAPT P10636 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
SCHEMBL13068734 0.82 CDK2 (0.32) ALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL10101932 0.81 ALDH1A1 (0.32) ALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL10101949 0.78 NPC1 (0.32) ALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL10106457 0.77 SMN1; SMN2 (0.33) ALDH1A1SMN1; SMN2NPC1RAB9AMAPT
SCHEMBL12905196 0.76 KMT2A (0.34) ALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL10101903 0.75
SCHEMBL10101841 0.74 NPC1 (0.30) NPC1RAB9A
SCHEMBL10102040 0.73 CSNK2A1 (0.43) ALDH1A1SMN1; SMN2
SCHEMBL10102113 0.73 TSHR (0.37) ALDH1A1
SCHEMBL10101958 0.73 TSHR (0.37) ALDH1A1

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