SCHEMBL5236147

SCHEMBL5236147

N#Cc1ccc2c(c1)C[C@H](NCc1ccccc1)CO2

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 4/20 0.47
DRD3 P35462 4/20 0.47
ABCB1 P08183 3/20 0.47
FYN P06241 1/20 0.46
KDM1A O60341 2/20 0.44
MAOA P21397 2/20 0.44
MAOB P27338 2/20 0.44
SLC6A4 P31645 1/20 0.43
MALT1 Q9UDY8 1/20 0.43
GRIN2B Q13224 1/20 0.43

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
SCHEMBL5241268 0.82 MALT1 (0.48) DRD2DRD3SLC6A4MALT1
SCHEMBL5240235 0.80 GRIN2B (0.56) DRD2DRD3FYNGRIN2B
SCHEMBL5240247 0.80 GRIN2B (0.56) DRD2DRD3FYNGRIN2B
SCHEMBL5243488 0.80 MALT1 (0.47) DRD2DRD3SLC6A4MALT1
SCHEMBL5240970 0.76 OPRM1 (0.49) FYNKDM1AMAOAMAOBGRIN2B
SCHEMBL7246202 0.76 SLC6A4 (0.46) DRD2DRD3ABCB1FYNKDM1A
SCHEMBL7246206 0.76 SLC6A4 (0.46) DRD2DRD3ABCB1FYNKDM1A
SCHEMBL14692494 0.74 DRD2 (0.42) DRD2DRD3ABCB1KDM1ASLC6A4
SCHEMBL22644953 0.73 FYN (0.49) DRD2DRD3FYNKDM1AGRIN2B
SCHEMBL5860952 0.72 MALT1 (0.49) DRD2DRD3MALT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1819690-A2 CHROMAN COMPOUNDS Pfizer Limited (GB) 2007-08-22 EP disclosed
WO-2006056850-A2 CHROMAN COMPOUNDS PFIZER LIMITED (GB) 2006-06-01 WO disclosed