SCHEMBL13884841

SCHEMBL13884841

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

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 2/20 0.52
▸ RAB9A P51151 2/20 0.52
▸ MEN1 O00255 2/20 0.52
▸ MAPT P10636 2/20 0.52
▸ KMT2A Q03164 2/20 0.52
▸ LMNA P02545 2/20 0.52
▸ MAPK1 P28482 2/20 0.52
▸ NPSR1 Q6W5P4 1/20 0.52
▸ TDP1 Q9NUW8 1/20 0.52
▸ L3MBTL1 Q9Y468 1/20 0.52
▸ PRKCA P17252 2/20 0.43
▸ SIRT2 Q8IXJ6 5/20 0.35
▸ MTOR P42345 1/20 0.35
▸ P2RY4 P51582 1/20 0.35
▸ MAOA P21397 1/20 0.34
▸ CYP1A2 P05177 2/20 0.34
▸ MET P08581 2/20 0.34
▸ HGF P14210 2/20 0.34
▸ EP300 Q09472 1/20 0.34
▸ TSHR P16473 1/20 0.34

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
SCHEMBL13884840 0.87 MEN1 (0.49) NPC1RAB9AMEN1MAPTKMT2A
SCHEMBL13893503 0.86 MEN1 (0.60) NPC1RAB9AMEN1MAPTKMT2A
SCHEMBL13884830 0.85 MEN1 (0.48) NPC1RAB9AMEN1MAPTKMT2A
SCHEMBL13884829 0.83 MAPT (0.61) NPC1RAB9AMEN1MAPTKMT2A
SCHEMBL13884850 0.82 NPC1 (0.41) NPC1RAB9AMEN1MAPTKMT2A
SCHEMBL13884831 0.82 MEN1 (0.63) NPC1RAB9AMEN1MAPTKMT2A
SCHEMBL13893551 0.81 NPC1 (0.59) NPC1RAB9AMEN1MAPTKMT2A
SCHEMBL13884737 0.80 MAPT (0.59) NPC1RAB9AMEN1MAPTKMT2A
SCHEMBL13884827 0.79 NPC1 (0.59) NPC1RAB9AMEN1MAPTKMT2A
SCHEMBL12798101 0.79 LMNA (0.52) 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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