SCHEMBL1259487

SCHEMBL1259487

CC1(c2cc(N=C(c3ccccc3)c3ccccc3)ccc2F)COC(Cc2ccccc2)C(=O)N1

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
OPRD1 P41143 1/20 0.34
MAPT P10636 1/20 0.32
PPARG P37231 1/20 0.31
PSMB5 P28074 1/20 0.31

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
SCHEMBL6923833 1.00 OPRD1 (0.34) OPRD1MAPTPPARGPSMB5
SCHEMBL6924256 1.00 OPRD1 (0.34) OPRD1MAPTPPARGPSMB5
SCHEMBL1173092 1.00 OPRD1 (0.34) OPRD1MAPTPPARGPSMB5
SCHEMBL11993565 1.00 OPRD1 (0.34) OPRD1MAPTPPARGPSMB5
SCHEMBL1173294 1.00 OPRD1 (0.34) OPRD1MAPTPPARGPSMB5
SCHEMBL1173683 0.84 OPRD1 (0.34) OPRD1
SCHEMBL1172975 0.84 OPRD1 (0.34) OPRD1
SCHEMBL1173512 0.81 BACE1 (0.34)
SCHEMBL11993564 0.81 BACE1 (0.37)
SCHEMBL1173202 0.81 BACE1 (0.37)

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-2467368-A1 3-AMINO-5-PHENYL-5,6-DIHYDRO-2H-[1,4]OXAZINE DERIVATIVES F. Hoffmann-La Roche AG (CH) 2012-06-27 EP disclosed
WO-2011020806-A1 3-AMINO-5-PHENYL-5,6-DIHYDRO-2H-[1,4]OXAZINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2011-02-24 WO disclosed