SCHEMBL13092535

SCHEMBL13092535

Nc1ccc(CCc2nnn[nH]2)c(F)c1

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ADRA2B P18089 1/20 0.39
ADORA3 P0DMS8 1/20 0.30
ADORA2A P29274 1/20 0.30
ADORA2B P29275 1/20 0.30
ADORA1 P30542 1/20 0.30
TAAR1 Q96RJ0 1/20 0.30
DAO P14920 1/20 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
SCHEMBL13092524 0.74 GFER (0.52)
SCHEMBL7239671 0.72 TAAR1 (0.54) ADRA2BTAAR1
SCHEMBL9872869 0.72 MAOA (0.53)
SCHEMBL26460682 0.70 ADRA2B (0.47) ADRA2BTAAR1
SCHEMBL1488954 0.70
SCHEMBL4671779 0.70
Hydrochloric Acid SCHEMBL9928911 0.68 HRH2 (0.31)
Hydrochloric Acid SCHEMBL1949038 0.68
SCHEMBL9057541 0.68 MAOB (0.44) DAO
SCHEMBL23413275 0.68 ADRA2B (0.45) ADRA2BTAAR1

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
WO-2010123017-A1 TETRAZOLE COMPOUND アステラス製薬株式会社 (JP) 2010-10-28 WO disclosed