SCHEMBL5509111

SCHEMBL5509111

O=C(CN1CC2C(CNCc3cccc(OC(F)(F)F)c3)C2C1)Nc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KCNA5 P22460 1/20 0.48
DRD4 P21917 1/20 0.47
GLS O94925 1/20 0.46
NAMPT P43490 1/20 0.45
P2RY14 Q15391 1/20 0.44
MAPK14 Q16539 1/20 0.44
CHRM4 P08173 1/20 0.43
PRMT5 O14744 1/20 0.43
WDR77 Q9BQA1 1/20 0.43
KMT2A Q03164 2/20 0.42
MEN1 O00255 1/20 0.42
ATM Q13315 1/20 0.42
CTSD P07339 1/20 0.42
BACE1 P56817 1/20 0.42
CARM1 Q86X55 1/20 0.42
PRMT6 Q96LA8 1/20 0.42
HPGD P15428 2/20 0.41
SLC6A9 P48067 1/20 0.41
KCNH2 Q12809 1/20 0.41

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
SCHEMBL15967271 0.90 GLS (0.44) DRD4GLSNAMPTP2RY14
SCHEMBL15967172 0.88 GLS (0.49) DRD4GLSCHRM4KMT2AMEN1
SCHEMBL5509348 0.87 GLS (0.45) DRD4GLSNAMPTMAPK14CHRM4
SCHEMBL5513288 0.86 CARM1 (0.45) GLSMAPK14CHRM4ATMCTSD
SCHEMBL15967109 0.86 CHRM4 (0.45) GLSMAPK14CHRM4CTSDBACE1
SCHEMBL5530672 0.86 CHRM4 (0.52) GLSMAPK14CHRM4KMT2AMEN1
SCHEMBL15967037 0.86 CARM1 (0.45) DRD4GLSNAMPTMAPK14CHRM4
SCHEMBL5513125 0.85 PIM1 (0.45) DRD4GLSNAMPTMAPK14CHRM4
SCHEMBL15967197 0.84 CHRM4 (0.44) GLSMAPK14CHRM4CTSDBACE1
SCHEMBL15967177 0.84 CARM1 (0.43) DRD4GLSMAPK14CHRM4ATM

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1869019-B1 BICYCLIC [3.1.0] HETEROARYL AMIDES AS TYPE I GLYCINE TRANSPORT INHIBITORS PFIZER PROD INC (US) 2014-08-27 EP claimed
EP-1869019-A1 BICYCLIC [3.1.0] HETEROARYL AMIDES AS TYPE I GLYCINE TRANSPORT INHIBITORS Pfizer Products Incorporated (US) 2007-12-26 EP claimed
WO-2006106425-A1 BICYCLIC [3.1.0] HETEROARYL AMIDES AS TYPE I GLYCINE TRANSPORT INHIBITORS PFIZER PRODUCTS INC. (US) 2006-10-12 WO claimed
EP-1869019-B1 BICYCLIC [3.1.0] HETEROARYL AMIDES AS TYPE I GLYCINE TRANSPORT INHIBITORS PFIZER PROD INC (US) 2014-08-27 EP disclosed