SCHEMBL931713

SCHEMBL931713

C=COc1c(C)cc(Br)cc1F

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
MAPT P10636 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
SCHEMBL930657 0.76 KDM4E (0.40) MAPT
SCHEMBL31327405 0.75 ERN1 (0.38)
SCHEMBL12579445 0.74 NFE2L2 (0.32)
SCHEMBL930098 0.70 HTR1A (0.36) MAPT
SCHEMBL23386893 0.69 ERN1 (0.31)
SCHEMBL3390811 0.69 TDP1 (0.36) MAPT
SCHEMBL3394195 0.69 RAPGEF4 (0.35) MAPT
SCHEMBL19453313 0.68 FFAR4 (0.32)
Ammonia Solution, Strong SCHEMBL27837347 0.67 RAPGEF4 (0.33)
SCHEMBL10986 0.66 CA2 (0.41) MAPT

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
WO-2011002409-A1 5H-PYRROLO[3,4-£>]PYRAZIN-7-AMINE DERIVATIVES INHIBITORS OF BETA-SECRETASE ASTRAZENECA AB (SE) 2011-01-06 WO disclosed
WO-2011002409-A1 5H-PYRROLO[3,4-£>]PYRAZIN-7-AMINE DERIVATIVES INHIBITORS OF BETA-SECRETASE ASTRAZENECA AB (SE) 2011-01-06 WO disclosed