SCHEMBL7086492

SCHEMBL7086492

Cn1cncc1C(c1ccc(C#N)c(-c2cccc3ccccc23)c1)[S+]([O-])Cc1ccc(C#N)cc1

nearest known ligand 0.69

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
FNTA P49354 5/20 0.69
FNTB P49356 5/20 0.69
PGGT1B P53609 4/20 0.69

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
SCHEMBL7086303 0.83 FNTA (0.71) FNTAFNTBPGGT1B
Hydrochloric Acid SCHEMBL7087288 0.83 FNTA (0.70) FNTAFNTBPGGT1B
SCHEMBL7086570 0.82 FNTA (0.71) FNTAFNTBPGGT1B
SCHEMBL7083765 0.82 PGGT1B (1.00) FNTAFNTBPGGT1B
Hydrochloric Acid SCHEMBL7569327 0.81 PGGT1B (0.98) FNTAFNTBPGGT1B
Hydrochloric Acid SCHEMBL7571070 0.81 FNTA (0.70) FNTAFNTBPGGT1B
SCHEMBL7088007 0.81 FNTA (0.70) FNTAFNTBPGGT1B
SCHEMBL7086494 0.80 FNTA (0.69) FNTAFNTBPGGT1B
SCHEMBL7569999 0.80 FNTA (0.90) FNTAFNTBPGGT1B
Hydrochloric Acid SCHEMBL7569490 0.80 FNTA (0.68) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1276726-A2 SUBSTITUTED PHENYL FARNESYLTRANSFERASE INHIBITORS Abbott Laboratories (US) 2003-01-22 EP disclosed
WO-2001081316-A2 SUBSTITUTED PHENYL FARNESYLTRANSFERASE INHIBITORS ABBOTT LABORATORIES (US) 2001-11-01 WO disclosed