SCHEMBL28038748

SCHEMBL28038748

CCCCCn1nc(CC)c(N)c1C(N)=O

nearest known ligand 0.44

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 3/20 0.39
CNR2 P34972 3/20 0.39
SMN1; SMN2 Q16637 1/20 0.37
TLR8 Q9NR97 2/20 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
SCHEMBL28038420 0.98 CNR1 (0.38) CNR1CNR2SMN1; SMN2TLR8
SCHEMBL28038715 0.98 CNR1 (0.38) CNR1CNR2SMN1; SMN2TLR8
SCHEMBL28038756 0.98 CNR1 (0.38) CNR1CNR2SMN1; SMN2TLR8
SCHEMBL28038425 0.89 SMN1; SMN2 (0.39) SMN1; SMN2
SCHEMBL3583127 0.81 TERT (0.35) CNR1CNR2SMN1; SMN2
SCHEMBL1527696 0.79 HCAR3 (0.34) SMN1; SMN2
SCHEMBL28038719 0.79 SMN1; SMN2 (0.56) CNR1CNR2SMN1; SMN2
SCHEMBL28038424 0.78 SMN1; SMN2 (0.55) CNR1CNR2SMN1; SMN2
SCHEMBL28038495 0.78 SMN1; SMN2 (0.55) CNR1CNR2SMN1; SMN2
SCHEMBL28038427 0.78 SMN1; SMN2 (0.55) CNR1CNR2SMN1; SMN2

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
CN-105037346-A Pyrazol bi-amide compounds containing 1,2,3-thiadiazole and synthetic method and application thereof UNIV CHINA AGRICULTURAL 2015-11-11 CN disclosed