SCHEMBL8608787

SCHEMBL8608787

CSCC[C@H](NC(=O)c1ccc(I)cc1-c1ccccc1)C(=O)O

nearest known ligand 0.63

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
FNTA P49354 4/20 0.63
FNTB P49356 4/20 0.63
PGGT1B P53609 1/20 0.63
TDP1 Q9NUW8 1/20 0.63

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
SCHEMBL8608792 1.00 FNTA (0.63) FNTAFNTBPGGT1BTDP1
SCHEMBL6775733 0.90 FNTA (0.65) FNTAFNTBPGGT1BTDP1
SCHEMBL6775738 0.90 FNTA (0.65) FNTAFNTBPGGT1BTDP1
SCHEMBL7918497 0.89 FNTA (0.66) FNTAFNTB
SCHEMBL7918500 0.89 FNTA (0.66) FNTAFNTB
SCHEMBL6624891 0.86 FNTA (0.66) FNTAFNTBPGGT1BTDP1
SCHEMBL6624887 0.86 FNTA (0.66) FNTAFNTBPGGT1BTDP1
SCHEMBL2329537 0.85 FNTA (0.61) FNTAFNTBPGGT1BTDP1
SCHEMBL8507922 0.84 FNTA (0.61) FNTAFNTBPGGT1BTDP1
SCHEMBL6627300 0.82 FNTA (0.79) FNTAFNTBPGGT1BTDP1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0873123-A4 INHIBITORS OF PROTEIN ISOPRENYL TRANSFERASES UNIV PITTSBURGH (US) 1999-02-03 EP disclosed
EP-0873123-A1 INHIBITORS OF PROTEIN ISOPRENYL TRANSFERASES UNIVERSITY OF PITTSBURGH (US) 1998-10-28 EP disclosed
WO-1997017070-A1 INHIBITORS OF PROTEIN ISOPRENYL TRANSFERASES UNIVERSITY OF PITTSBURGH (US) 1997-05-15 WO disclosed