SCHEMBL7168685

SCHEMBL7168685

Cc1ncc(CN2CCN(c3cccc4ccc(OCc5ccccc5)cc34)C(=O)C2)n1Cc1ccc(C#N)c(F)c1

nearest known ligand 0.47

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FNTA P49354 17/20 0.47
FNTB P49356 17/20 0.47
PGGT1B P53609 14/20 0.47
HTR1A P08908 1/20 0.35
HTR1D P28221 1/20 0.35
HTR1B P28222 1/20 0.35

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
SCHEMBL7168181 0.89 FNTA (0.41) FNTAFNTBPGGT1B
SCHEMBL6523879 0.87 FNTA (0.62) FNTAFNTBPGGT1B
SCHEMBL7163140 0.87 FNTA (0.46) FNTAFNTBPGGT1BHTR1AHTR1D
SCHEMBL7566909 0.82 FNTA (0.41) FNTAFNTBPGGT1B
SCHEMBL7165178 0.82 FNTA (0.62) FNTAFNTBPGGT1B
SCHEMBL6526286 0.77 FNTA (0.49) FNTAFNTBPGGT1BHTR1AHTR1D
SCHEMBL6409378 0.77 HTR1A (0.35) FNTAFNTBPGGT1BHTR1AHTR1D
SCHEMBL6410632 0.76 HTR1A (0.35) FNTAFNTBPGGT1BHTR1AHTR1D
SCHEMBL7166236 0.75 FNTA (0.37) FNTAFNTBPGGT1BHTR1AHTR1D
SCHEMBL7161933 0.74 FNTA (0.40) FNTAFNTBPGGT1B

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-6562823-B1 Inhibition of farnesyl-protein transferase has been shown to block the growth of Ras-transformed cells in soft agar MERCK & CO., INC. 2003-05-13 US disclosed