SCHEMBL5023658

SCHEMBL5023658

Cc1cc(CNc2nc(Nc3ccccc3)nc(Nc3ccc(F)cc3)n2)ccn1

nearest known ligand 0.76

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
KCNH3 Q9ULD8 20/20 0.76

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
SCHEMBL1281719 0.88 KCNH3 (0.97) KCNH3
Hydrochloric Acid SCHEMBL541197 0.86 KCNH3 (1.00) KCNH3
SCHEMBL5015093 0.84 KCNH3 (0.74) KCNH3
SCHEMBL5015077 0.83 KCNH3 (0.82) KCNH3
SCHEMBL1923916 0.82 KCNH3 (0.97) KCNH3
SCHEMBL1923802 0.82 KCNH3 (0.88) KCNH3
SCHEMBL1924293 0.81 KCNH3 (0.98) KCNH3
Hydrochloric Acid SCHEMBL3413936 0.81 KCNH3 (1.00) KCNH3
Hydrochloric Acid SCHEMBL3410329 0.81 KCNH3 (1.00) KCNH3
SCHEMBL1923791 0.80 KCNH3 (0.97) 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