SCHEMBL9107485

SCHEMBL9107485

CC1OCc2c(N)nc(N)nc21

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HRH2 P25021 1/20 0.33
HRH3 Q9Y5N1 1/20 0.33
HCAR2 Q8TDS4 1/20 0.31
ADORA2A P29274 2/20 0.30

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
SCHEMBL9107481 0.69
SCHEMBL512796 0.68 HRH3 (0.33) HRH2HRH3
SCHEMBL11791725 0.64 HCAR2 (0.30) HCAR2
Propylene Oxide SCHEMBL6866878 0.62 LMNA (0.35) HRH2HRH3
SCHEMBL1226524 0.59 KDM4E (0.37)
SCHEMBL4424819 0.58 HRH3 (0.44) HRH2HRH3
SCHEMBL28877816 0.56 DHFR (0.41) HRH2HRH3
SCHEMBL7940046 0.54 ADORA2A (0.48) ADORA2A
SCHEMBL31041484 0.53 KDM4E (0.33)
SCHEMBL10049719 0.52 LMNA (0.39) ADORA2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2459197-A1 COMPOUNDS FOR THE REDUCTION OF -AMYLOID PRODUCTION Bristol-Myers Squibb Company (US) 2012-06-06 EP claimed