SCHEMBL13201663

SCHEMBL13201663

Cc1cc(N=Nc2ccccc2)ccc1Nc1nc(Cl)nc(Nc2ccc(N=Nc3ccc4ccccc4c3)cc2)n1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 4/20 0.46
▸ MEN1 O00255 3/20 0.46
▸ MAPT P10636 3/20 0.46
▸ MAPK1 P28482 1/20 0.46
▸ LMNA P02545 1/20 0.44
▸ NPC1 O15118 4/20 0.43
▸ RAB9A P51151 3/20 0.43
▸ HSP90AA1 P07900 2/20 0.43
▸ NFKB1 P19838 3/20 0.43
▸ SMN1; SMN2 Q16637 2/20 0.41
▸ APP P05067 3/20 0.41
▸ CA12 O43570 2/20 0.39
▸ CA1 P00915 2/20 0.39
▸ CA2 P00918 2/20 0.39
▸ CA9 Q16790 2/20 0.39
▸ GAA P10253 1/20 0.38
▸ KDM4E B2RXH2 1/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ POLB P06746 1/20 0.37

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
SCHEMBL12301036 1.00 KMT2A (0.46) KMT2AMEN1MAPTMAPK1LMNA
SCHEMBL13797706 0.87 MEN1 (0.41) KMT2AMEN1MAPTMAPK1LMNA
SCHEMBL13201664 0.87 TSHR (0.46) KMT2AMEN1MAPTMAPK1LMNA
SCHEMBL14280919 0.87 MAPT (0.56) KMT2AMEN1MAPTMAPK1LMNA
SCHEMBL13330296 0.86 MAPT (0.42) KMT2AMEN1MAPTMAPK1LMNA
SCHEMBL13201659 0.82 MEN1 (0.40) KMT2AMEN1NPC1RAB9AHSP90AA1
SCHEMBL13797708 0.81 KCNH3 (0.42) NPC1RAB9A
SCHEMBL6123719 0.80 MAPT (0.70) KMT2AMEN1MAPTMAPK1LMNA
SCHEMBL13313311 0.80 MAPT (0.70) KMT2AMEN1MAPTMAPK1LMNA
SCHEMBL1401200 0.78 NFKB1 (0.70) KMT2AMEN1MAPTMAPK1LMNA

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-7771525-B2 Water-soluble azo compound or salt thereof, ink composition and colored product NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2010-08-10 — — US disclosed
US-20100068475-A1 WATER-SOLUBLE AZO COMPOUND OR SALT THEREOF, INK COMPOSITION AND COLORED PRODUCT NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2010-03-18 — — US disclosed
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