SCHEMBL7937504

SCHEMBL7937504

N#Cc1ccc(Cn2cncc2CNC2CCN(C(=O)c3cncc4ccccc34)C2)cc1

nearest known ligand 0.87

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
FNTA P49354 19/20 0.87
FNTB P49356 19/20 0.87
PGGT1B P53609 11/20 0.87
KCNH2 Q12809 3/20 0.68

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
SCHEMBL7937500 1.00 FNTA (0.87) FNTAFNTBPGGT1BKCNH2
SCHEMBL7936919 0.93 FNTA (1.00) FNTAFNTBPGGT1BKCNH2
SCHEMBL7936914 0.93 FNTA (1.00) FNTAFNTBPGGT1BKCNH2
SCHEMBL7933879 0.85 FNTA (0.81) FNTAFNTBPGGT1BKCNH2
SCHEMBL7934020 0.83 FNTA (0.82) FNTAFNTBPGGT1BKCNH2
SCHEMBL7937393 0.83 FNTA (0.82) FNTAFNTBPGGT1BKCNH2
SCHEMBL7934029 0.83 FNTA (0.82) FNTAFNTBPGGT1BKCNH2
SCHEMBL7927663 0.83 FNTA (0.81) FNTAFNTBPGGT1BKCNH2
SCHEMBL7927550 0.82 FNTA (1.00) FNTAFNTBPGGT1BKCNH2
Hydrochloric Acid SCHEMBL7927486 0.82 FNTA (0.80) FNTAFNTBPGGT1BKCNH2

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-2001017992-A1 INHIBITORS OF PRENYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 2001-03-15 WO disclosed