SCHEMBL5328000

SCHEMBL5328000

Cn1c(CN2C[C@@H]3[C@H](CO)[C@@H]3C2)nc2ccccc21

nearest known ligand 0.69

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 6/20 0.55
DRD2 P14416 3/20 0.55
DRD3 P35462 3/20 0.55
DRD4 P21917 3/20 0.55
LMNA P02545 2/20 0.52
PKM P14618 1/20 0.52
POLB P06746 1/20 0.50
GAA P10253 1/20 0.50
MAPK1 P28482 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50

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
SCHEMBL5325773 1.00 GRM2 (0.55) GRM2DRD2DRD3DRD4LMNA
SCHEMBL5327996 1.00 GRM2 (0.55) GRM2DRD2DRD3DRD4LMNA
SCHEMBL5324285 1.00 GRM2 (0.55) GRM2DRD2DRD3DRD4LMNA
SCHEMBL5321874 0.87 GRM2 (0.55) GRM2DRD2DRD3DRD4LMNA
SCHEMBL5326833 0.84 GRM2 (0.57) GRM2DRD2DRD3DRD4LMNA
SCHEMBL5325461 0.84 GRM2 (0.57) GRM2DRD2DRD3DRD4LMNA
SCHEMBL5325322 0.84 GRM2 (0.57) GRM2DRD2DRD3DRD4LMNA
SCHEMBL5322551 0.83 GRM2 (0.54) GRM2DRD2DRD3DRD4LMNA
SCHEMBL5322682 0.83 GRM2 (0.56) GRM2DRD2DRD3DRD4LMNA
SCHEMBL5328099 0.81 GRM2 (0.51) 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
WO-2007135527-A2 BENZIMIDAZOLYL COMPOUNDS PFIZER PRODUCTS INC. (US) 2007-11-29 WO disclosed