SCHEMBL8447945

SCHEMBL8447945

Cc1ncc([CH]C(F)F)s1

nearest known ligand 0.39

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 1/20 0.39
HDAC1 Q13547 1/20 0.33
HDAC2 Q92769 1/20 0.33
AOC3 Q16853 2/20 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
SCHEMBL8448203 0.75 ALDH1A1 (0.31)
SCHEMBL13574820 0.71
SCHEMBL550353 0.71
SCHEMBL20880240 0.70
SCHEMBL22723764 0.70
SCHEMBL8445941 0.68
SCHEMBL8448155 0.67 MAPT (0.52)
SCHEMBL21610741 0.67
SCHEMBL10442596 0.66 HCAR2 (0.46) HCAR2AOC3
SCHEMBL903234 0.65 HDAC1 (0.38) HCAR2HDAC1HDAC2

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-0942909-A1 BICYCLIC AMINE DERIVATIVES ZENECA LIMITED (GB) 1999-09-22 EP disclosed
WO-1998022463-A1 BICYCLIC AMINE DERIVATIVES ZENECA LIMITED (GB) 1998-05-28 WO disclosed