SCHEMBL22792269

SCHEMBL22792269

C[C@@H]1CN(C2CC2)C(=O)O1

nearest known ligand 0.43

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NPY5R Q15761 2/20 0.43
VNN1 O95497 1/20 0.39
CA1 P00915 1/20 0.37
CA9 Q16790 1/20 0.37
GRM2 Q14416 13/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
HTR2B P41595 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
SCHEMBL23966947 1.00 NPY5R (0.43) NPY5RVNN1CA1CA9GRM2
SCHEMBL22252447 0.92 NPY5R (0.39) NPY5RVNN1CA1CA9GRM2
SCHEMBL6553035 0.90 GRM2 (0.40) NPY5RVNN1GRM2HTR2B
SCHEMBL3074193 0.87 NPY5R (0.37) NPY5RVNN1CA1CA9GRM2
SCHEMBL3069122 0.87 NPY5R (0.37) NPY5RVNN1CA1CA9GRM2
SCHEMBL3780308 0.87 NPY5R (0.37) NPY5RVNN1CA1CA9GRM2
SCHEMBL14081449 0.87 VNN1 (0.40) NPY5RVNN1CA1CA9GRM2
SCHEMBL21989900 0.80 VNN1 (0.34) NPY5RVNN1GRM2HTR2B
SCHEMBL23966948 0.75 NPY5R (0.32) NPY5R
SCHEMBL22788172 0.74 HTR2B (0.45) GRM2HTR2B

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
WO-2020249791-A1 SUBSTITUTED PYRAZOLO[4,3-b]PYRIDINES AND THEIR USE AS GLUN2B RECEPTOR MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2020-12-17 WO disclosed