SCHEMBL824629

SCHEMBL824629

[C-]#[N+]c1cnn(-c2nc(OC)nc(OC)n2)c1/N=N/c1c(C)nn(-c2ncccn2)c1N

nearest known ligand 0.34

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.34
RAB9A P51151 5/20 0.34
SMN1; SMN2 Q16637 5/20 0.34
NPC1 O15118 4/20 0.34
TDP1 Q9NUW8 4/20 0.33
HPGD P15428 2/20 0.33
ALDH1A1 P00352 1/20 0.33
MAPK1 P28482 3/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
L3MBTL1 Q9Y468 2/20 0.31
ALOX12 P18054 1/20 0.31
HTT P42858 1/20 0.31
LMNA P02545 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
SCHEMBL824570 0.82 MAPT (0.50) MAPTRAB9ASMN1; SMN2NPC1TDP1
SCHEMBL824869 0.82 MAPT (0.53) MAPTRAB9ASMN1; SMN2NPC1TDP1
SCHEMBL824572 0.82 MAPT (0.39) MAPTRAB9ASMN1; SMN2NPC1TDP1
SCHEMBL10194308 0.79 SMN1; SMN2 (0.40) MAPTRAB9ASMN1; SMN2NPC1TDP1
SCHEMBL10194364 0.78 MAPT (0.34) MAPTRAB9ASMN1; SMN2NPC1TDP1
SCHEMBL10194367 0.78 MAPT (0.33) MAPTRAB9ASMN1; SMN2NPC1TDP1
SCHEMBL824593 0.77 MAPT (0.56) MAPTRAB9ASMN1; SMN2NPC1TDP1
SCHEMBL10194365 0.76 MAPT (0.33) MAPTRAB9ASMN1; SMN2NPC1TDP1
SCHEMBL12052317 0.74
SCHEMBL10234010 0.73 NPC1 (0.40) MAPTRAB9ASMN1; SMN2NPC1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8142519-B2 Azo pigment, and pigment dispersion, coloring composition and ink composition for inkjet recording containing the same FUJIFILM CORPORATION (JP) 2012-03-27 US disclosed
US-20100258036-A1 AZO PIGMENT, AND PIGMENT DISPERSION, COLORING COMPOSITION AND INK COMPOSITION FOR INKJET RECORDING CONTAINING THE SAME FUJIFILM CORPORATION (JP) 2010-10-14 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100258036-A1 AZO PIGMENT, AND PIGMENT DISPERSION, COLORING COMPOSITION AND INK COMPOSITION FOR INKJET RECORDING CONTAINING THE SAME WNT1, CYP1A1, CYP1B1 MAPT 372/4885RAB9A 910/4885SMN1; SMN2 3717/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.