SCHEMBL7461096

SCHEMBL7461096

CNc1cc(N)cc(OC)c1O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 3/20 0.40
▸ MAPT P10636 3/20 0.40
▸ TSHR P16473 1/20 0.40
▸ MAPK1 P28482 1/20 0.40
▸ HTT P42858 1/20 0.40
▸ PTGS2 P35354 2/20 0.37
▸ CA12 O43570 1/20 0.37
▸ CA1 P00915 1/20 0.37
▸ CA2 P00918 1/20 0.37
▸ CA3 P07451 1/20 0.37
▸ PKM P14618 1/20 0.37
▸ CA4 P22748 1/20 0.37
▸ CA6 P23280 1/20 0.37
▸ CA5A P35218 1/20 0.37
▸ CA7 P43166 1/20 0.37
▸ CA9 Q16790 1/20 0.37
▸ CA14 Q9ULX7 1/20 0.37
▸ CA5B Q9Y2D0 1/20 0.37
▸ ALOX5 P09917 1/20 0.37
▸ LMNA P02545 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
SCHEMBL2002815 0.81 PKM (0.52) GAAMAPTTSHRMAPK1HTT
SCHEMBL14394423 0.78 ABL1 (0.47) GAAMAPTMAPK1PTGS2CA12
SCHEMBL10933696 0.78 PTGS2 (0.38) GAAMAPTMAPK1PTGS2CA12
SCHEMBL13963710 0.77 PTGS2 (0.50) GAAMAPTTSHRMAPK1HTT
SCHEMBL26097042 0.77 MAPT (0.44) GAAMAPTTSHRMAPK1HTT
SCHEMBL11016393 0.74 ALDH1A1 (0.40) GAAMAPTTSHRHTTCA1
SCHEMBL11330721 0.74 EGFR (0.46) GAAMAPTTSHRMAPK1HTT
SCHEMBL11344842 0.72 MAPT (0.52) GAAMAPTTSHRMAPK1HTT
SCHEMBL1438002 0.72 THRB (0.60) GAAMAPTPTGS2CA12CA1
SCHEMBL7105484 0.72 MAPT (0.57) GAAMAPTTSHRMAPK1HTT

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
EP-1231889-A2 DIRECT HAIR DYES AND USE THEREOF Henkel Kommanditgesellschaft auf Aktien (DE) 2002-08-21 — — EP disclosed
EP-1169012-A1 COLORANTS CONTAINING 4-AMINO-2-AMINOMETHYL-PHENOL DERIVATIVES AND THEIR USE FOR COLORING KERATIN FIBERS Henkel Kommanditgesellschaft auf Aktien (DE) 2002-01-09 — — EP disclosed
WO-2001026615-A2 DIRECT HAIR DYES CONTAINING A HYDROXYANTHROQUINONE DERIVATIVE HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2001-04-19 — — WO disclosed
WO-2000061088-A1 COLORANTS CONTAINING 4-AMINO-2-AMINOMETHYL-PHENOL DERIVATIVES AND THEIR USE FOR COLORING KERATIN FIBERS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2000-10-19 — — WO disclosed
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