SCHEMBL13330296

SCHEMBL13330296

Cc1cc(Nc2nc(Cl)nc(Nc3ccc(N=Nc4ccccc4)cc3C)n2)ccc1N=Nc1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.42
▸ KMT2A Q03164 2/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ MAPK1 P28482 1/20 0.42
▸ APP P05067 4/20 0.40
▸ LMNA P02545 1/20 0.40
▸ NFKB1 P19838 2/20 0.40
▸ TERT O14746 1/20 0.38
▸ NPC1 O15118 2/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ TRPA1 O75762 1/20 0.38
▸ FUT8 Q9BYC5 1/20 0.37
▸ POLB P06746 1/20 0.37
▸ CA12 O43570 2/20 0.36
▸ CA1 P00915 2/20 0.36
▸ CA2 P00918 2/20 0.36
▸ CA9 Q16790 2/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL13201664 0.86 TSHR (0.46) MAPTKMT2AMEN1MAPK1LMNA
SCHEMBL13201663 0.86 KMT2A (0.46) MAPTKMT2AMEN1MAPK1APP
SCHEMBL12301036 0.86 KMT2A (0.46) MAPTKMT2AMEN1MAPK1APP
SCHEMBL13797708 0.77 KCNH3 (0.42) NPC1RAB9A
SCHEMBL6123719 0.77 MAPT (0.70) MAPTKMT2AMEN1MAPK1LMNA
SCHEMBL13313311 0.77 MAPT (0.70) MAPTKMT2AMEN1MAPK1LMNA
SCHEMBL13762793 0.77 APP (0.41) MAPTKMT2AMEN1MAPK1APP
SCHEMBL13889382 0.75 IDH2 (0.37) MAPTKMT2AMEN1MAPK1APP
SCHEMBL10284775 0.74 FUT8 (0.48) FUT8CA12CA1CA2CA9
SCHEMBL1401200 0.74 NFKB1 (0.70) MAPTKMT2AMEN1MAPK1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100118067-A1 WATER-SOLUBLE AZO COMPOUND OR SALT THEREOF, INK COMPOSITION AND COLORED PRODUCT NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2010-05-13 — — US disclosed
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