SCHEMBL8097128

SCHEMBL8097128

O=C1OCNN1c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 8/20 0.42
ALOX12 P18054 3/20 0.42
LMNA P02545 1/20 0.42
RECQL P46063 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
KMT2A Q03164 5/20 0.39
MEN1 O00255 4/20 0.39
MAPT P10636 3/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
ALDH1A1 P00352 4/20 0.38
GSK3A P49840 2/20 0.38
GSK3B P49841 2/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
POLB P06746 1/20 0.37
NPSR1 Q6W5P4 1/20 0.36
ALOX5 P09917 1/20 0.36

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
SCHEMBL10579386 0.81 ALDH1A1 (0.43) GAALMNAKMT2AMEN1MAPT
SCHEMBL7645366 0.67 GAA (0.41) GAAALOX12LMNARECQLKMT2A
SCHEMBL6735952 0.65 NPC1 (0.40) GAAALOX12LMNARECQLKMT2A
SCHEMBL5668872 0.65 GAA (0.43) GAAALOX12LMNARECQLKMT2A
SCHEMBL6248177 0.64 DDB1 (0.47) GAAALOX12LMNARECQLL3MBTL1
SCHEMBL3362762 0.64 NPC1 (0.52) GAAKMT2AMEN1MAPTALDH1A1
SCHEMBL22295525 0.63 POLB (0.34) GAAALOX12LMNARECQLL3MBTL1
SCHEMBL6930626 0.62 GAA (0.40) GAAALOX12LMNARECQLL3MBTL1
SCHEMBL9597146 0.62 ALDH1A1 (0.39) GAAALOX12LMNARECQLL3MBTL1
SCHEMBL11048264 0.62 GAA (0.47) GAAALOX12LMNAL3MBTL1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0854871-B1 1,3,4-OXADIAZOLIN-2-ONES AND THEIR USE AS PESTICIDES BAYER AG (DE) 2000-08-16 EP claimed
US-6013804-A FOR CONTROLLING ANIMAL PESTS BAYER AKTIENGESELLSCHAFT (DE) 2000-01-11 US claimed
EP-0854871-A1 1,3,4-OXADIAZOLIN-2-ONES AND THEIR USE AS PESTICIDES BAYER AG (DE) 1998-07-29 EP claimed
WO-1997008158-A1 1,3,4-OXADIAZOLIN-2-ONES AND THEIR USE AS PESTICIDES BAYER AKTIENGESELLSCHAFT (DE) 1997-03-06 WO claimed
EP-0854871-B1 1,3,4-OXADIAZOLIN-2-ONES AND THEIR USE AS PESTICIDES BAYER AG (DE) 2000-08-16 EP disclosed
US-6013804-A FOR CONTROLLING ANIMAL PESTS BAYER AKTIENGESELLSCHAFT (DE) 2000-01-11 US disclosed
EP-0854871-A1 1,3,4-OXADIAZOLIN-2-ONES AND THEIR USE AS PESTICIDES BAYER AG (DE) 1998-07-29 EP disclosed
WO-1997008158-A1 1,3,4-OXADIAZOLIN-2-ONES AND THEIR USE AS PESTICIDES BAYER AKTIENGESELLSCHAFT (DE) 1997-03-06 WO disclosed