SCHEMBL6209031

SCHEMBL6209031

NC(=O)Oc1ccc2c(c1)OCCCC2=O

nearest known ligand 0.57

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 6/20 0.57
MAPT P10636 4/20 0.47
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
HSD17B10 Q99714 1/20 0.47
MAOB P27338 14/20 0.47
MAOA P21397 1/20 0.47
ALDH1A1 P00352 2/20 0.46
NPC1 O15118 1/20 0.46
HPGD P15428 1/20 0.46
NFKB1 P19838 1/20 0.46
RAB9A P51151 1/20 0.46
NFKB2 Q00653 1/20 0.46
RELA Q04206 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
ACHE P22303 1/20 0.43
CYP2C9 P11712 1/20 0.42

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
SCHEMBL29196216 0.92 GRM5 (0.67) GRM5MAPTMEN1KMT2AHSD17B10
SCHEMBL20165273 0.83 GRM5 (0.54) GRM5MAPTMEN1KMT2AHSD17B10
SCHEMBL31279913 0.80 MAOB (0.52) GRM5MAOBMAOAALDH1A1NPC1
SCHEMBL10334859 0.80 MAOB (0.52) GRM5MAOBMAOAALDH1A1NPC1
SCHEMBL27762425 0.77 GRM5 (0.67) GRM5MAPTMEN1KMT2AHSD17B10
SCHEMBL6628767 0.77 MAOA (0.54) MEN1KMT2AMAOBMAOA
SCHEMBL21081795 0.76 GRM5 (0.42) GRM5MAPTMEN1KMT2AHSD17B10
SCHEMBL6365078 0.76 GRM5 (0.56) GRM5MAPTMEN1KMT2AHSD17B10
SCHEMBL29177251 0.76 MEN1 (0.47) GRM5MEN1KMT2ASMN1; SMN2
SCHEMBL7605647 0.76 GRM5 (0.49) GRM5MAPTMEN1KMT2AHSD17B10

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1594495-A1 OXAZOLIDINONE DERIVATES N-SUBSTITUTED BY A TRICYCLIC RING, FOR USE AS ANTIBACTERIAL AGENTS Warner-Lambert Company LLC (US) 2005-11-16 EP disclosed
WO-2004069245-A1 OXAZOLIDINONE DERIVATES N-SUBSTITUTED BY A TRICYCLIC RING, FOR USE AS ANTIBACTERIAL AGENTS WARNER-LAMBERT COMPANY LLC (US) 2004-08-19 WO disclosed