SCHEMBL483675

SCHEMBL483675

O=CCN(C(=O)O)c1ccc(N2CCOCC2)c(F)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.51
HPGD P15428 4/20 0.51
RAB9A P51151 3/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
TP53 P04637 1/20 0.51
ALOX15 P16050 1/20 0.51
TSHR P16473 1/20 0.51
MAPK1 P28482 1/20 0.51
ALDH1A1 P00352 3/20 0.47
LMNA P02545 3/20 0.47
HTT P42858 2/20 0.46
KDM4E B2RXH2 2/20 0.46
CYP1A2 P05177 2/20 0.46
CYP3A4 P08684 2/20 0.46
CYP2C19 P33261 2/20 0.46
CASP1 P29466 1/20 0.46
L3MBTL1 Q9Y468 2/20 0.45
MAPT P10636 1/20 0.45
KMT2A Q03164 1/20 0.42
MAOB P27338 2/20 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
SCHEMBL8425448 0.84 HPGD (0.56) NPC1HPGDRAB9ASMN1; SMN2TP53
SCHEMBL483657 0.84 NPC1 (0.49) NPC1HPGDRAB9ASMN1; SMN2TP53
SCHEMBL483922 0.84 NPC1 (0.47) NPC1HPGDRAB9ASMN1; SMN2TP53
SCHEMBL8425426 0.83 NPC1 (0.50) NPC1HPGDRAB9ASMN1; SMN2TP53
SCHEMBL18595786 0.82 HPGD (0.48) NPC1HPGDRAB9ASMN1; SMN2TP53
SCHEMBL483612 0.82 NPC1 (0.44) NPC1HPGDRAB9ASMN1; SMN2TP53
SCHEMBL15618877 0.81 NPC1 (0.47) NPC1HPGDRAB9ASMN1; SMN2TP53
SCHEMBL15618875 0.81 NPC1 (0.47) NPC1HPGDRAB9ASMN1; SMN2TP53
SCHEMBL18595785 0.81 NPC1 (0.46) NPC1HPGDRAB9ASMN1; SMN2TP53
SCHEMBL484062 0.81 NPC1 (0.46) NPC1HPGDRAB9ASMN1; SMN2TP53

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
EP-2072505-B1 A process for the preparation of oxazolidinone derivatives DIPHARMA FRANCIS SRL (IT) 2012-02-01 EP claimed