SCHEMBL8626003

SCHEMBL8626003

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

nearest known ligand 0.56

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FNTA P49354 8/20 0.56
FNTB P49356 8/20 0.56
NPSR1 Q6W5P4 1/20 0.44
CA2 P00918 4/20 0.43
CA1 P00915 3/20 0.43
SMN1; SMN2 Q16637 1/20 0.42

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
SCHEMBL8623007 0.89 FNTA (0.67) FNTAFNTBNPSR1CA2CA1
SCHEMBL8621284 0.88 FNTA (0.52) FNTAFNTBCA2CA1
SCHEMBL8623835 0.84 FNTA (0.52) FNTAFNTBNPSR1CA2CA1
SCHEMBL8623763 0.79 FNTA (0.57) FNTAFNTBNPSR1CA2CA1
SCHEMBL8623996 0.78 FNTA (0.60) FNTAFNTBNPSR1CA2CA1
SCHEMBL8626201 0.76 FNTA (0.48) FNTAFNTBCA2CA1
SCHEMBL2324069 0.75 FNTA (0.62) FNTAFNTBNPSR1CA2CA1
SCHEMBL9828951 0.75 FNTA (0.62) FNTAFNTBNPSR1CA2CA1
SCHEMBL8626764 0.73 FNTA (0.60) FNTAFNTB
SCHEMBL6624887 0.71 FNTA (0.66) FNTAFNTB

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-0842150-A1 NOVEL FARNESYL TRANSFERASE INHIBITORS, PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAID INHIBITORS Aventis Pharma S.A. (FR) 1998-05-20 EP disclosed
WO-1997003047-A1 NOVEL FARNESYL TRANSFERASE INHIBITORS, PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAID INHIBITORS Rhône-Poulenc Rorer S.A. (FR) 1997-01-30 WO disclosed