SCHEMBL17546367

SCHEMBL17546367

CCOCc1nnc2c(C)c(C=O)ccn12

nearest known ligand 0.40

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 2/20 0.40

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
SCHEMBL4562407 0.82 GRM2 (0.50) GRM2
SCHEMBL740953 0.79 GRM2 (0.45) GRM2
SCHEMBL10819349 0.76 GRM2 (0.44) GRM2
SCHEMBL4562272 0.72 GRM2 (0.48) GRM2
SCHEMBL741619 0.69 GRM2 (0.42) GRM2
SCHEMBL21745150 0.69 CA12 (0.41)
SCHEMBL21713326 0.69 CYP1A2 (0.45)
SCHEMBL21713652 0.69 KCNJ1 (0.31)
SCHEMBL21714210 0.68 HSD11B1 (0.40)
SCHEMBL21713998 0.67 SMN1; SMN2 (0.35) GRM2

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
US-9271967-B2 1,2,4-triazolo[4,3-a]pyridine derivatives and their use as positive allosteric modulators of mGluR2 receptors Janssen Pharmaceuticals, Inc. (US) 2016-03-01 US disclosed