SCHEMBL15947721

SCHEMBL15947721

COC(=O)[C@H](CO)NC(=O)c1ccccc1OCc1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ SGMS2 Q8NHU3 6/20 0.56
▸ NPC1 O15118 1/20 0.54
▸ GAA P10253 1/20 0.53
▸ CTSK P43235 1/20 0.53
▸ ICMT O60725 1/20 0.52
▸ MEN1 O00255 3/20 0.51
▸ KMT2A Q03164 3/20 0.51
▸ LMNA P02545 1/20 0.51
▸ MAPT P10636 1/20 0.51
▸ L3MBTL1 Q9Y468 1/20 0.51
▸ ALDH1A1 P00352 1/20 0.51
▸ KIFC1 Q9BW19 1/20 0.50
▸ FAAH O00519 1/20 0.48
▸ CNR1 P21554 1/20 0.48
▸ CNR2 P34972 1/20 0.48
▸ HTT P42858 1/20 0.48

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
SCHEMBL7723439 0.91 SGMS2 (0.58) SGMS2NPC1GAACTSKICMT
SCHEMBL7725875 0.89 SGMS2 (0.56) SGMS2NPC1GAACTSKICMT
SCHEMBL7695955 0.88 SGMS2 (0.60) SGMS2NPC1GAACTSKICMT
SCHEMBL27560784 0.88 SGMS2 (0.60) SGMS2NPC1GAACTSKICMT
SCHEMBL12984496 0.84 CTSD (0.58) NPC1GAAKMT2ALMNAMAPT
SCHEMBL7956090 0.81 SGMS2 (0.55) SGMS2NPC1GAACTSKMEN1
SCHEMBL7956086 0.81 SGMS2 (0.55) SGMS2NPC1GAACTSKMEN1
SCHEMBL15947711 0.81 SGMS2 (0.55) SGMS2NPC1GAACTSKMEN1
SCHEMBL15941245 0.81 SGMS2 (0.55) SGMS2NPC1GAACTSKMEN1
SCHEMBL3973755 0.81 KIFC1 (0.59) GAAKIFC1

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
WO-2014122664-A1 LANTHANIDE CLUSTERS AND METHODS OF USE THEREOF YEDA RESEARCH AND DEVELOPMENT CO. LTD. (IL) 2014-08-14 — — WO disclosed
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