SCHEMBL7212255

SCHEMBL7212255

O=C1OC(COc2ccon2)CN1c1cc(F)cc(F)c1

nearest known ligand 0.47

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 17/20 0.47
MAOA P21397 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
SCHEMBL7466839 1.00 GRM2 (0.47) GRM2MAOA
SCHEMBL12674050 0.88 MAOA (0.47) GRM2MAOA
SCHEMBL12665376 0.85 GRM2 (0.46) GRM2MAOA
SCHEMBL12964876 0.85 MAOA (0.46) GRM2MAOA
SCHEMBL6023876 0.84 MAOA (0.45) GRM2MAOA
SCHEMBL15458108 0.84 MAOA (0.45) GRM2MAOA
SCHEMBL6081089 0.84 MAOA (0.45) GRM2MAOA
SCHEMBL2842759 0.84 CALML3 (0.46) GRM2MAOA
SCHEMBL18770270 0.84 MAOA (0.45) GRM2MAOA
SCHEMBL7078471 0.83 MAOA (0.46) MAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2003515539-A 2003-05-07 JP claimed
EP-1237895-A2 PHOSPHORYLATION OF TERMINAL PRIMARY ALCOHOL GROUPS AstraZeneca AB (SE) 2002-09-11 EP claimed
WO-2001040236-A2 PHOSPHORYLATION OF TERMINAL PRIMARY ALCOHOL GROUPS ASTRAZENECA AB (SE) 2001-06-07 WO claimed
EP-1237895-A2 PHOSPHORYLATION OF TERMINAL PRIMARY ALCOHOL GROUPS AstraZeneca AB (SE) 2002-09-11 EP disclosed
WO-2001040236-A2 PHOSPHORYLATION OF TERMINAL PRIMARY ALCOHOL GROUPS ASTRAZENECA AB (SE) 2001-06-07 WO disclosed