SCHEMBL5328524

SCHEMBL5328524

Cn1c(CN2CC3C(C2)C3CN(Cc2ccccc2)S(=O)(=O)CC(F)(F)F)nc2ccccc21

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
GRM2 Q14416 6/20 0.42
DRD4 P21917 4/20 0.42
DRD2 P14416 2/20 0.42
DRD3 P35462 2/20 0.42
ALDH1A1 P00352 1/20 0.40
LMNA P02545 1/20 0.40
GAA P10253 1/20 0.40
NPSR1 Q6W5P4 1/20 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
SCHEMBL5322728 0.81 GRM2 (0.51) GRM2DRD4DRD2DRD3LMNA
SCHEMBL5322682 0.74 GRM2 (0.56) GRM2DRD4DRD2DRD3LMNA
SCHEMBL5326693 0.71 GRM2 (0.51) SMN1; SMN2GRM2DRD4DRD2DRD3
SCHEMBL5328000 0.71 GRM2 (0.55) SMN1; SMN2GRM2DRD4DRD2DRD3
SCHEMBL5327996 0.71 GRM2 (0.55) SMN1; SMN2GRM2DRD4DRD2DRD3
SCHEMBL5321874 0.71 GRM2 (0.55) SMN1; SMN2GRM2DRD4DRD2DRD3
SCHEMBL5324285 0.71 GRM2 (0.55) SMN1; SMN2GRM2DRD4DRD2DRD3
SCHEMBL5325773 0.71 GRM2 (0.55) SMN1; SMN2GRM2DRD4DRD2DRD3
SCHEMBL5328515 0.70 GRM2 (0.59) GRM2DRD4DRD2DRD3
SCHEMBL5321848 0.70 GRM2 (0.49) GRM2DRD4DRD2DRD3ALDH1A1

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