SCHEMBL460646

SCHEMBL460646

Cn1cncc1CN(CCc1cccc(S(=O)(=O)NCC2CCCCC2)n1)c1ccc(C#N)cn1

nearest known ligand 0.62

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
FNTA P49354 19/20 0.62
FNTB P49356 19/20 0.62
PGGT1B P53609 12/20 0.62

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
SCHEMBL15124383 0.77 FNTA (1.00) FNTAFNTBPGGT1B
SCHEMBL452628 0.76 FNTA (0.60) FNTAFNTBPGGT1B
SCHEMBL453392 0.73 FNTA (0.63) FNTAFNTBPGGT1B
SCHEMBL4892549 0.68 FNTA (0.59) FNTAFNTBPGGT1B
SCHEMBL453965 0.68 FNTA (0.50) FNTAFNTBPGGT1B
SCHEMBL15124696 0.67 FNTA (1.00) FNTAFNTBPGGT1B
SCHEMBL13989943 0.66 FNTA (1.00) FNTAFNTBPGGT1B
SCHEMBL17295308 0.66 FNTA (0.48) FNTAFNTBPGGT1B
SCHEMBL15124883 0.65 FNTA (0.70) FNTAFNTBPGGT1B
SCHEMBL31534292 0.64 FNTA (1.00) 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
WO-2012034038-A2 DUAL INHIBITORS OF FARNESYLTRANSFERASE AND GERANYLGERANYLTRANSFERASE I H. LEE MOFFITT CANCER CENTER AND RESEARCH INSTITUTE, INC. (US) 2012-03-15 WO disclosed