SCHEMBL13884730

SCHEMBL13884730

O=C(NCNC(=O)OCCc1ccc(Nc2ccc(O)c3c2C(=O)c2ccccc2C3=O)cc1)OCCc1ccc(Nc2ccc(O)c3c2C(=O)c2ccccc2C3=O)cc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 4/20 0.67
▸ KMT2A Q03164 4/20 0.67
▸ MAPT P10636 3/20 0.67
▸ NPC1 O15118 2/20 0.67
▸ RAB9A P51151 2/20 0.67
▸ LMNA P02545 2/20 0.67
▸ MAPK1 P28482 2/20 0.67
▸ TDP1 Q9NUW8 2/20 0.67
▸ NPSR1 Q6W5P4 1/20 0.67
▸ L3MBTL1 Q9Y468 1/20 0.67
▸ PRKCA P17252 2/20 0.49
▸ MTOR P42345 1/20 0.43
▸ SIRT2 Q8IXJ6 1/20 0.43
▸ MAOA P21397 1/20 0.40
▸ CYP1A2 P05177 3/20 0.39
▸ TSHR P16473 2/20 0.39
▸ HIF1A Q16665 2/20 0.36
▸ CYP2C19 P33261 1/20 0.36
▸ HSD17B10 Q99714 1/20 0.36
▸ POLB P06746 3/20 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
SCHEMBL13893449 0.89 MAPT (0.67) MEN1KMT2AMAPTNPC1RAB9A
SCHEMBL30749688 0.89 MAPT (0.61) MEN1KMT2AMAPTNPC1RAB9A
SCHEMBL13884777 0.89 MEN1 (0.52) MEN1KMT2AMAPTNPC1RAB9A
SCHEMBL13884741 0.88 MAPT (0.71) MEN1KMT2AMAPTNPC1RAB9A
SCHEMBL13295527 0.87 MAPT (0.69) MEN1KMT2AMAPTNPC1RAB9A
SCHEMBL13884827 0.86 NPC1 (0.59) MEN1KMT2AMAPTNPC1RAB9A
SCHEMBL13884749 0.86 MEN1 (0.48) MEN1KMT2AMAPTNPC1RAB9A
SCHEMBL1987556 0.85 NPC1 (0.67) MEN1KMT2AMAPTNPC1RAB9A
SCHEMBL13178023 0.83 MAPT (0.64) MEN1KMT2AMAPTNPC1RAB9A
SCHEMBL13884735 0.83 NPC1 (0.53) MEN1KMT2AMAPTNPC1RAB9A

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-7524979-B2 Methods of making colorant compounds XEROX CORPORATION (US) 2009-04-28 — — US disclosed
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