SCHEMBL13893564

SCHEMBL13893564

CNC(=O)OCc1ccc(-c2cc(Br)c(Nc3ccc(O)c4c3C(=O)c3ccccc3C4=O)c(Br)c2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 3/20 0.46
▸ RAB9A P51151 3/20 0.46
▸ MEN1 O00255 2/20 0.46
▸ MAPT P10636 2/20 0.46
▸ KMT2A Q03164 2/20 0.46
▸ LMNA P02545 1/20 0.46
▸ MAPK1 P28482 1/20 0.46
▸ NPSR1 Q6W5P4 1/20 0.46
▸ TDP1 Q9NUW8 1/20 0.46
▸ L3MBTL1 Q9Y468 1/20 0.46
▸ PLAUR Q03405 2/20 0.39
▸ PRKCA P17252 2/20 0.38
▸ MMP12 P39900 1/20 0.37
▸ MMP13 P45452 1/20 0.37
▸ PTPN1 P18031 2/20 0.37
▸ ENPP2 Q13822 1/20 0.36
▸ MTOR P42345 1/20 0.36
▸ SIRT2 Q8IXJ6 1/20 0.36
▸ TOP2A P11388 2/20 0.36
▸ TOP2B Q02880 2/20 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
SCHEMBL13884839 0.91 NPC1 (0.46) NPC1RAB9AMEN1MAPTKMT2A
SCHEMBL13884838 0.91 NPC1 (0.47) NPC1RAB9AMEN1MAPTKMT2A
SCHEMBL13884847 0.90 MEN1 (0.48) NPC1RAB9AMEN1MAPTKMT2A
SCHEMBL13893551 0.88 NPC1 (0.59) NPC1RAB9AMEN1MAPTKMT2A
SCHEMBL13884856 0.84 MAPT (0.53) NPC1RAB9AMEN1MAPTKMT2A
SCHEMBL13893454 0.84 MEN1 (0.48) NPC1RAB9AMEN1MAPTKMT2A
SCHEMBL13884850 0.84 NPC1 (0.41) NPC1RAB9AMEN1MAPTKMT2A
SCHEMBL13884843 0.83 SIRT2 (0.40) NPC1RAB9AMEN1MAPTKMT2A
SCHEMBL13884855 0.81 MEN1 (0.39) NPC1RAB9AMEN1MAPTKMT2A
SCHEMBL13893505 0.81 MEN1 (0.47) NPC1RAB9AMEN1MAPTKMT2A

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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