SCHEMBL8099693

SCHEMBL8099693

O=c1oc(-c2c(F)cccc2F)nn1-c1ccc(-c2ccc(OC(F)(F)F)cc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 1/20 0.41
SCN5A Q14524 3/20 0.38
ABHD16A O95870 1/20 0.37
TRPV4 Q9HBA0 2/20 0.37
FAAH O00519 1/20 0.37
MGLL Q99685 1/20 0.37
NPBWR1 P48145 2/20 0.36
MCHR1 Q99705 2/20 0.36
MAPT P10636 3/20 0.36
TYK2 P29597 1/20 0.36
PDE10A Q9Y233 1/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
POLB P06746 1/20 0.36
MAPK1 P28482 2/20 0.35
KDM4E B2RXH2 1/20 0.35
GAA P10253 1/20 0.35
RECQL P46063 1/20 0.35
HCRTR1 O43613 1/20 0.35
HCRTR2 O43614 1/20 0.35

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
SCHEMBL8099611 0.82 ABHD16A (0.38) ABHD16AL3MBTL1POLBKDM4E
SCHEMBL10473995 0.80 F7 (0.47) NOTUMABHD16ATRPV4MAPTKDM4E
SCHEMBL10474089 0.80 MAPT (0.41) ABHD16AMGLLMAPT
SCHEMBL10475132 0.79 MAPT (0.44) NOTUMSCN5ANPBWR1MCHR1MAPT
SCHEMBL10474205 0.79 MAPT (0.42) NOTUMMGLLMAPTHCRTR1HCRTR2
SCHEMBL10690957 0.78 POLB (0.44) NOTUMSCN5ATRPV4NPBWR1MCHR1
SCHEMBL8093252 0.77 ABHD16A (0.40) ABHD16AFAAHMGLLMAPTPOLB
SCHEMBL10473965 0.76 MAPT (0.41) MAPTL3MBTL1KDM4EHCRTR1HCRTR2
SCHEMBL10475127 0.75 NPBWR1 (0.44) NOTUMFAAHMGLLNPBWR1MCHR1
SCHEMBL10475073 0.75 AR (0.43) MAPT

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 3 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 disclosed
US-6013804-A FOR CONTROLLING ANIMAL PESTS BAYER AKTIENGESELLSCHAFT (DE) 2000-01-11 US disclosed
WO-1997008158-A1 1,3,4-OXADIAZOLIN-2-ONES AND THEIR USE AS PESTICIDES BAYER AKTIENGESELLSCHAFT (DE) 1997-03-06 WO disclosed