SCHEMBL28186377

SCHEMBL28186377

OCn1nnc(Cc2ccccc2)n1

nearest known ligand 0.59

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 4/20 0.59
TRPV1 Q8NER1 4/20 0.59
CNR1 P21554 1/20 0.59
HDAC6 Q9UBN7 2/20 0.58
MGLL Q99685 8/20 0.47
DAGLA Q9Y4D2 1/20 0.47
RAB9A P51151 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
NR1H2 P55055 1/20 0.41
NR1H3 Q13133 1/20 0.41

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
SCHEMBL4405605 0.87 HDAC6 (0.68) CNR2TRPV1CNR1HDAC6MGLL
SCHEMBL4404110 0.82 TRPV1 (0.59) CNR2TRPV1CNR1HDAC6MGLL
SCHEMBL4407129 0.81 TRPV1 (0.86) CNR2TRPV1CNR1HDAC6MGLL
SCHEMBL4407827 0.79 CNR2 (0.56) CNR2TRPV1CNR1HDAC6MGLL
SCHEMBL10730709 0.79 CNR2 (0.57) CNR2TRPV1CNR1HDAC6MGLL
SCHEMBL4407046 0.78 TRPV1 (0.55) CNR2TRPV1CNR1HDAC6MGLL
SCHEMBL836445 0.77 CNR2 (0.50) CNR2TRPV1CNR1HDAC6MGLL
SCHEMBL4411302 0.77 CNR2 (0.54) CNR2TRPV1CNR1HDAC6MGLL
SCHEMBL4407064 0.76 CNR2 (0.52) CNR2TRPV1CNR1HDAC6MGLL
SCHEMBL31272767 0.76 HDAC6 (0.58) CNR2TRPV1CNR1HDAC6MGLL

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
CN-106083929-B A kind of tetrazolium phosphate compound and synthetic method with eelworm-killing activity 安徽农业大学 2017-12-15 CN disclosed
CN-106083929-A A kind of tetrazolium phosphate compound with eelworm-killing activity and synthetic method 安徽农业大学 2016-11-09 CN disclosed