SCHEMBL13893449

SCHEMBL13893449

CNC(=O)OCCc1ccc(Nc2ccc(O)c3c2C(=O)c2ccccc2C3=O)cc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.67
▸ NPC1 O15118 2/20 0.67
▸ RAB9A P51151 2/20 0.67
▸ MEN1 O00255 2/20 0.67
▸ KMT2A Q03164 2/20 0.67
▸ LMNA P02545 2/20 0.67
▸ MAPK1 P28482 2/20 0.67
▸ NPSR1 Q6W5P4 1/20 0.67
▸ TDP1 Q9NUW8 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
▸ GNG2 P59768 1/20 0.38
▸ GNB1 P62873 1/20 0.38
▸ P2RY4 P51582 3/20 0.37
▸ P2RY12 Q9H244 2/20 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
SCHEMBL13884730 0.89 MEN1 (0.67) MAPTNPC1RAB9AMEN1KMT2A
SCHEMBL13295527 0.89 MAPT (0.69) MAPTNPC1RAB9AMEN1KMT2A
SCHEMBL13884741 0.88 MAPT (0.71) MAPTNPC1RAB9AMEN1KMT2A
SCHEMBL13893551 0.86 NPC1 (0.59) MAPTNPC1RAB9AMEN1KMT2A
SCHEMBL13893454 0.86 MEN1 (0.48) MAPTNPC1RAB9AMEN1KMT2A
SCHEMBL13178023 0.85 MAPT (0.64) MAPTNPC1RAB9AMEN1KMT2A
SCHEMBL1987556 0.85 NPC1 (0.67) MAPTNPC1RAB9AMEN1KMT2A
SCHEMBL30749688 0.85 MAPT (0.61) MAPTNPC1RAB9AMEN1KMT2A
SCHEMBL13473966 0.84 MAPT (0.71) MAPTNPC1RAB9AMEN1KMT2A
SCHEMBL13884737 0.81 MAPT (0.59) MAPTNPC1RAB9AMEN1KMT2A

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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