SCHEMBL7936825

SCHEMBL7936825

N#Cc1ccc(Cn2cncc2CC(=O)NC2CCN(c3ccccc3)C2=O)cc1

nearest known ligand 0.76

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
FNTA P49354 20/20 0.76
FNTB P49356 20/20 0.76
PGGT1B P53609 14/20 0.76
KCNH2 Q12809 2/20 0.66

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
SCHEMBL7936820 1.00 FNTA (0.76) FNTAFNTBPGGT1BKCNH2
Hydrochloric Acid SCHEMBL7927518 0.99 FNTA (0.75) FNTAFNTBPGGT1BKCNH2
Hydrochloric Acid SCHEMBL7927515 0.99 FNTA (0.75) FNTAFNTBPGGT1BKCNH2
Hydrochloric Acid SCHEMBL7939558 0.98 FNTA (0.74) FNTAFNTBPGGT1BKCNH2
Hydrochloric Acid SCHEMBL7939552 0.98 FNTA (0.74) FNTAFNTBPGGT1BKCNH2
SCHEMBL7935995 0.89 FNTA (0.76) FNTAFNTBPGGT1BKCNH2
SCHEMBL7935993 0.89 FNTA (0.76) FNTAFNTBPGGT1BKCNH2
Hydrochloric Acid SCHEMBL7927524 0.88 FNTA (0.75) FNTAFNTBPGGT1BKCNH2
Hydrochloric Acid SCHEMBL7927526 0.88 FNTA (0.75) FNTAFNTBPGGT1BKCNH2
SCHEMBL7936811 0.86 FNTA (1.00) 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