Sugi Predict

Sugi Predict / Compounds / SCHEMBL8750304

SCHEMBL8750304

SCHEMBL8750304

CSCC[C@H](NC(=O)c1cccc2cc(NC[C@@H](N)CS)ccc12)C(=O)O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ FNTA P49354 20/20 1.00
▸ FNTB P49356 18/20 1.00
▸ PGGT1B P53609 8/20 0.71
▸ TDP1 Q9NUW8 3/20 0.71

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
SCHEMBL29450593 0.91 FNTA (1.00) FNTAFNTBPGGT1BTDP1
SCHEMBL8626782 0.90 FNTA (0.82) FNTAFNTBPGGT1BTDP1
SCHEMBL8418719 0.86 FNTA (0.76) FNTAFNTBPGGT1BTDP1
SCHEMBL8418712 0.86 FNTA (0.76) FNTAFNTBPGGT1BTDP1
SCHEMBL8750233 0.85 FNTA (1.00) FNTAFNTBPGGT1BTDP1
SCHEMBL16111993 0.83 FNTA (1.00) FNTAFNTBPGGT1BTDP1
SCHEMBL17534949 0.83 FNTA (1.00) FNTAFNTBPGGT1BTDP1
SCHEMBL2722114 0.83 FNTA (1.00) FNTAFNTBPGGT1BTDP1
SCHEMBL8492288 0.83 FNTA (1.00) FNTAFNTBPGGT1BTDP1
SCHEMBL4148121 0.83 FNTA (1.00) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0764149-A1 NOVEL FARNESYL TRANSFERASE INHIBITORS, THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME Aventis Pharma S.A. (FR) 1997-03-26 — — EP disclosed
WO-1995034535-A1 NOVEL FARNESYL TRANSFERASE INHIBITORS, THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME RHONE-POULENC RORER S.A. (FR) 1995-12-21 — — WO disclosed