SCHEMBL13893503

SCHEMBL13893503

CC(C)C(=O)OCc1ccc(-c2ccc(Nc3ccc(O)c4c3C(=O)c3ccccc3C4=O)cc2)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.60
▸ NPC1 O15118 2/20 0.60
▸ MAPT P10636 2/20 0.60
▸ RAB9A P51151 2/20 0.60
▸ KMT2A Q03164 2/20 0.60
▸ LMNA P02545 1/20 0.60
▸ MAPK1 P28482 1/20 0.60
▸ NPSR1 Q6W5P4 1/20 0.60
▸ TDP1 Q9NUW8 1/20 0.60
▸ L3MBTL1 Q9Y468 1/20 0.60
▸ PRKCA P17252 2/20 0.49
▸ MET P08581 3/20 0.41
▸ HGF P14210 2/20 0.41
▸ MAOA P21397 1/20 0.40
▸ MTOR P42345 1/20 0.40
▸ SIRT2 Q8IXJ6 1/20 0.40
▸ P2RY4 P51582 5/20 0.40
▸ P2RY2 P41231 4/20 0.40
▸ P2RY12 Q9H244 4/20 0.40
▸ P2RY6 Q15077 3/20 0.40

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
SCHEMBL13884829 0.90 MAPT (0.61) MEN1NPC1MAPTRAB9AKMT2A
SCHEMBL13884831 0.89 MEN1 (0.63) MEN1NPC1MAPTRAB9AKMT2A
SCHEMBL13893551 0.88 NPC1 (0.59) MEN1NPC1MAPTRAB9AKMT2A
SCHEMBL13884827 0.86 NPC1 (0.59) MEN1NPC1MAPTRAB9AKMT2A
SCHEMBL13884841 0.86 NPC1 (0.52) MEN1NPC1MAPTRAB9AKMT2A
SCHEMBL13884828 0.83 MEN1 (0.70) MEN1NPC1MAPTRAB9AKMT2A
SCHEMBL13473993 0.81 MAPT (0.67) MEN1NPC1MAPTRAB9AKMT2A
SCHEMBL13884840 0.80 MEN1 (0.49) MEN1NPC1MAPTRAB9AKMT2A
SCHEMBL13893905 0.79 MEN1 (0.74) MEN1NPC1MAPTRAB9AKMT2A
SCHEMBL13884838 0.79 NPC1 (0.47) MEN1NPC1MAPTRAB9AKMT2A

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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