SCHEMBL5023640

SCHEMBL5023640

Fc1ccc(Nc2nc(NCc3cccnn3)nc(Nc3ccccc3)n2)cc1

nearest known ligand 0.64

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
KCNH3 Q9ULD8 20/20 0.64

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
SCHEMBL1924158 0.81 KCNH3 (0.71) KCNH3
SCHEMBL1923864 0.78 KCNH3 (0.90) KCNH3
Hydrochloric Acid SCHEMBL1924152 0.78 KCNH3 (1.00) KCNH3
SCHEMBL535908 0.78 KCNH3 (1.00) KCNH3
SCHEMBL1923791 0.77 KCNH3 (0.97) KCNH3
SCHEMBL5023655 0.76 KCNH3 (0.68) KCNH3
SCHEMBL1925525 0.75 KCNH3 (0.62) KCNH3
SCHEMBL5015520 0.75 KCNH3 (0.62) KCNH3
Hydrochloric Acid SCHEMBL5015545 0.74 KCNH3 (0.61) KCNH3
SCHEMBL1923808 0.74 MAOA (0.69) KCNH3

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
US-7375222-B2 2,4,6-Triamino-1,3,5-triazine derivative ASTELLAS PHARMA INC. (JP) 2008-05-20 US claimed