SCHEMBL5326693

SCHEMBL5326693

Cn1c(CN2CC3C(CNCc4ccccc4)C3C2)nc2ccccc21

nearest known ligand 0.63

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 5/20 0.51
DRD2 P14416 3/20 0.51
DRD4 P21917 3/20 0.51
DRD3 P35462 3/20 0.51
KDM4E B2RXH2 1/20 0.46
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
LMNA P02545 1/20 0.45
PKM P14618 1/20 0.45

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
SCHEMBL5322682 0.83 GRM2 (0.56) GRM2DRD2DRD4DRD3LMNA
SCHEMBL5322728 0.80 GRM2 (0.51) GRM2DRD2DRD4DRD3LMNA
SCHEMBL5321874 0.80 GRM2 (0.55) GRM2DRD2DRD4DRD3SMN1; SMN2
SCHEMBL5327996 0.80 GRM2 (0.55) GRM2DRD2DRD4DRD3SMN1; SMN2
SCHEMBL5324285 0.80 GRM2 (0.55) GRM2DRD2DRD4DRD3SMN1; SMN2
SCHEMBL5328000 0.80 GRM2 (0.55) GRM2DRD2DRD4DRD3SMN1; SMN2
SCHEMBL5325773 0.80 GRM2 (0.55) GRM2DRD2DRD4DRD3SMN1; SMN2
SCHEMBL5326833 0.77 GRM2 (0.57) GRM2DRD2DRD4DRD3SMN1; SMN2
SCHEMBL5325461 0.77 GRM2 (0.57) GRM2DRD2DRD4DRD3SMN1; SMN2
SCHEMBL5325322 0.77 GRM2 (0.57) GRM2DRD2DRD4DRD3SMN1; 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
WO-2007135527-A2 BENZIMIDAZOLYL COMPOUNDS PFIZER PRODUCTS INC. (US) 2007-11-29 WO disclosed