SCHEMBL27617872

SCHEMBL27617872

O=C1CCCC2C1=CC=CC2Br

nearest known ligand 0.38

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.38

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
SCHEMBL19012777 0.73
SCHEMBL5614240 0.73 MAPT (0.37) MAPT
SCHEMBL28399318 0.70 MAPT (0.37) MAPT
SCHEMBL6247864 0.68 MAPT (0.36) MAPT
SCHEMBL5384505 0.67 MAPT (0.35) MAPT
SCHEMBL27510905 0.67
SCHEMBL12406898 0.65
SCHEMBL27580970 0.64
SCHEMBL29283789 0.64 MAPT (0.36) MAPT
SCHEMBL3293899 0.63 MAPT (0.42) 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
CN-100384824-C Acetyl 2-hydroxy-1, 3-diaminoalkanes PHARMACIA & UPJOHN CO LLC (US) 2008-04-30 CN disclosed
CN-1694870-A Acetyl 2-hydroxy-1, 3-diaminoalkanes PHARMACIA & UPJOHN CO LLC (US) 2005-11-09 CN disclosed