SCHEMBL6123694

SCHEMBL6123694

Cc1nc(Nc2ccc(N=Nc3ccc(N=Nc4ccccc4)cc3)cc2)nc(Nc2ccc(N=Nc3ccc(N=Nc4ccccc4)cc3)cc2)n1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ KCNH3 Q9ULD8 7/20 0.46
▸ MAPT P10636 4/20 0.46
▸ MEN1 O00255 3/20 0.46
▸ KMT2A Q03164 3/20 0.46
▸ GAA P10253 2/20 0.46
▸ KDM4E B2RXH2 2/20 0.46
▸ MAPK1 P28482 1/20 0.46
▸ SMN1; SMN2 Q16637 2/20 0.45
▸ NPC1 O15118 1/20 0.45
▸ RAB9A P51151 1/20 0.45
▸ HTT P42858 2/20 0.44
▸ LMNA P02545 2/20 0.44
▸ ALDH1A1 P00352 2/20 0.42
▸ NPY5R Q15761 1/20 0.42
▸ NFKB1 P19838 1/20 0.42
▸ DDX3X O00571 1/20 0.41

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
SCHEMBL14189802 1.00 KCNH3 (0.46) KCNH3MAPTMEN1KMT2AGAA
SCHEMBL6123868 0.97 MAPT (0.45) KCNH3MAPTMEN1KMT2AGAA
SCHEMBL7517592 0.91 MAPT (0.53) KCNH3MAPTMEN1KMT2AGAA
SCHEMBL11936604 0.83 MAPT (0.63) KCNH3MAPTMEN1KMT2AGAA
SCHEMBL14357408 0.83 MEN1 (0.49) MAPTMEN1KMT2AGAAMAPK1
SCHEMBL6123719 0.83 MAPT (0.70) KCNH3MAPTMEN1KMT2AGAA
SCHEMBL13313311 0.83 MAPT (0.70) KCNH3MAPTMEN1KMT2AGAA
SCHEMBL12191769 0.81 MAPT (0.41) KCNH3MAPTMEN1KMT2AGAA
SCHEMBL11923410 0.81 MEN1 (0.41) KCNH3MAPTMEN1KMT2AGAA
SCHEMBL1401124 0.79 CA12 (0.49) KCNH3MAPTMEN1KMT2AGAA

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-8167991-B2 Trisazo compound, ink composition, recording method, and colored article NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2012-05-01 — — US disclosed
US-7566362-B2 Ink, ink jet recording method, ink cartridge, recording unit and ink jet recording apparatus CANON KABUSHIKI KAISHA (JP) 2009-07-28 — — US disclosed
US-20090062545-A1 Trisazo Compound, Ink Composition, Recording Method, and Colored Article NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2009-03-05 — — US disclosed
US-20090047430-A1 INK, INK JET RECORDING METHOD, INK CARTRIDGE, RECORDING UNIT AND INK JET RECORDING APPARATUS CANON KABUSHIKI KAISHA (JP) 2009-02-19 — — 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-20090062545-A1 Trisazo Compound, Ink Composition, Recording Method, and Colored Article JAK1, TMT1A, CDK1 KCNH3 304/4885MAPT 2129/4885MEN1 2042/4885

“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.

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