SCHEMBL8201474

SCHEMBL8201474

Nc1cccc(-c2ccccc2C2=NCCN2)c1

nearest known ligand 0.69

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
NISCH Q9Y2I1 14/20 0.69
ADRA2A P08913 1/20 0.55
ADRA2B P18089 1/20 0.55
ADRA2C P18825 1/20 0.55
MAP4K4 O95819 1/20 0.47
MAOB P27338 1/20 0.47

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
SCHEMBL4094123 0.85 NISCH (0.67) NISCHMAOB
SCHEMBL29446967 0.85 NISCH (0.67) NISCHMAOB
Hydrochloric Acid SCHEMBL27888413 0.84 NISCH (0.65) NISCHMAOB
Hydrochloric Acid SCHEMBL29755905 0.84 NISCH (0.65) NISCHMAOB
Hydrochloric Acid SCHEMBL1143198 0.83 NISCH (0.63) NISCHMAOB
SCHEMBL8204316 0.82 NISCH (0.74) NISCHADRA2AADRA2BADRA2CMAOB
SCHEMBL8195024 0.81 NISCH (0.67) NISCHMAOB
SCHEMBL9579892 0.80 NISCH (0.81) NISCH
SCHEMBL8201878 0.80 NISCH (0.51) NISCHADRA2AADRA2BADRA2CMAOB
SCHEMBL8204363 0.78 NISCH (0.76) NISCHMAOB

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-2000078726-A1 IMIDAZOLINE DERIVATIVES FOR THE TREATMENT OF DIABETES, ESPECIALLY TYPE II DIABETES ELI LILLY AND COMPANY (US) 2000-12-28 WO disclosed