SCHEMBL28794877

SCHEMBL28794877

C#CCn1c(C)c(C)sc1=N

nearest known ligand 0.37

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 1/20 0.31

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
Bromide SCHEMBL3383625 0.98 CNR2 (0.30) CNR2
SCHEMBL9520707 0.76 CNR2 (0.33) CNR2
SCHEMBL9520703 0.62 CNR2 (0.32) CNR2
SCHEMBL15360059 0.61
SCHEMBL9521296 0.59 TKT (0.35) CNR2
SCHEMBL9583043 0.59 CNR2 (0.31) CNR2
SCHEMBL9520853 0.58 CNR2 (0.30) CNR2
SCHEMBL13281475 0.57 ADORA2B (0.35)
SCHEMBL15357747 0.57
SCHEMBL1629499 0.55 ADORA2B (0.39)

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-101925300-A Novel compounds as cannabinoid receptor ligands and uses thereof ABBOTT LAB 2010-12-22 CN disclosed