SCHEMBL16189751

SCHEMBL16189751

CC[C@@H](O)CNc1ccc(N2CCOCC2)c(F)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.50
HTT P42858 3/20 0.49
L3MBTL1 Q9Y468 2/20 0.49
RAB9A P51151 3/20 0.48
KMT2A Q03164 1/20 0.47
GAA P10253 5/20 0.46
ALOX15 P16050 3/20 0.46
MAPK1 P28482 2/20 0.46
MAPT P10636 1/20 0.46
LDHA P00338 1/20 0.46
LDHB P07195 1/20 0.46
ALDH1A1 P00352 4/20 0.45
LMNA P02545 4/20 0.45
HPGD P15428 3/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
TSHR P16473 2/20 0.43
TP53 P04637 1/20 0.43
HSD17B10 Q99714 1/20 0.43
KDM4E B2RXH2 2/20 0.43
MAOA P21397 1/20 0.43

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
SCHEMBL15623485 0.90 HTT (0.49) NPC1HTTL3MBTL1RAB9AKMT2A
SCHEMBL2867969 0.90 HTT (0.49) NPC1HTTL3MBTL1RAB9AKMT2A
SCHEMBL5417803 0.90 HTT (0.49) NPC1HTTL3MBTL1RAB9AKMT2A
SCHEMBL15618724 0.90 HTT (0.49) NPC1HTTL3MBTL1RAB9AKMT2A
SCHEMBL12126890 0.90 HTT (0.49) NPC1HTTL3MBTL1RAB9AKMT2A
SCHEMBL23030168 0.90 HTT (0.49) NPC1HTTL3MBTL1RAB9AKMT2A
SCHEMBL28998621 0.89 HTT (0.48) NPC1HTTL3MBTL1RAB9AKMT2A
SCHEMBL13316510 0.88 KDM4E (0.40) NPC1HTTL3MBTL1RAB9AKMT2A
SCHEMBL15440582 0.86 LMNA (0.52) NPC1HTTL3MBTL1RAB9AKMT2A
SCHEMBL30226901 0.86 LMNA (0.52) NPC1HTTL3MBTL1RAB9AKMT2A

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-2014170908-A1 PROCESS FOR PREPARATION OF OXAZOLIDINONE DERIVATIVES NOSCH LABS PRIVATE LIMITED (IN) 2014-10-23 WO disclosed