SCHEMBL28029818

SCHEMBL28029818

C=CC(=N)c1ccn(C)c1

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
INMT O95050 2/20 0.33

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
SCHEMBL20054149 0.73 SLC18A3 (0.30)
SCHEMBL14367264 0.72
SCHEMBL9825319 0.70
SCHEMBL27374631 0.68
SCHEMBL334557 0.66
SCHEMBL23416837 0.66 LMNA (0.48)
SCHEMBL28480552 0.65 PRSS1 (0.55)
SCHEMBL14311364 0.64 AKT1 (0.52)
SCHEMBL5062781 0.64
SCHEMBL19159756 0.64

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
CN-104876974-A Ferrocene tetrazole ionic compounds and preparation method thereof UNIV SHAANXI NORMAL 2015-09-02 CN disclosed