SCHEMBL27366767

SCHEMBL27366767

CN(C)C(=O)c1ccc2c(n1)CCC(C(O)CC(=O)O)C2

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 1/20 0.32
KDM4A O75164 1/20 0.32
DRD2 P14416 2/20 0.31
DRD3 P35462 2/20 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
SCHEMBL27366761 0.83 LMNA (0.32) CNR2DRD2DRD3
SCHEMBL27367125 0.77 MCHR1 (0.39) DRD2DRD3
SCHEMBL27366691 0.71 PDK1 (0.46) CNR2DRD2DRD3
SCHEMBL27367022 0.68 HTR2C (0.45)
SCHEMBL4209564 0.66 HTR2C (0.37) KDM4A
SCHEMBL4201295 0.65 KDM4A (0.37) CNR2KDM4ADRD2
SCHEMBL18365931 0.64 KDM4E (0.40)
SCHEMBL32660912 0.63 F10 (0.36) CNR2KDM4A
SCHEMBL27367100 0.61 MCHR1 (0.38) DRD2DRD3
SCHEMBL27366718 0.61 PDK1 (0.45) DRD2DRD3

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-2024049929-A2 PANNEXIN-1 MODULATORS AND METHODS OF TREATING DISORDERS IN WHICH PANNEXIN-1 IS IMPLICATED PANNEX THERAPEUTICS INC. (US) 2024-03-07 WO disclosed