SCHEMBL8679247

SCHEMBL8679247

COC(=O)CN1C(=O)C(NCC(=O)OC(C)(C)C)CCc2ccccc21

nearest known ligand 0.68

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CCKBR P32239 4/20 0.61
SCN9A Q15858 1/20 0.53
ACE P12821 1/20 0.51

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
SCHEMBL8940589 0.92 ACE (0.59) CCKBRACE
SCHEMBL8676920 0.92 ACE (0.59) CCKBRACE
SCHEMBL7486160 0.83 CCKBR (0.72) CCKBRSCN9A
SCHEMBL7486156 0.83 CCKBR (0.72) CCKBRSCN9A
SCHEMBL7359930 0.81 ACE (0.59) CCKBRACE
SCHEMBL8283797 0.79 CCKBR (0.61) CCKBR
SCHEMBL7353391 0.79 ACE (0.52) CCKBRACE
SCHEMBL4797181 0.79 PYGL (0.55) CCKBR
SCHEMBL4797202 0.79 PYGL (0.55) CCKBR
SCHEMBL5698825 0.78 CCKBR (0.60) CCKBR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5843941-A Ras farnesyl transferase inhibitors GENENTECH, INC. (US) 1998-12-01 US disclosed
EP-0763537-A2 Non-peptidyl Ras farnesyl transferase inhibitors GENENTECH, INC. (US) 1997-03-19 EP disclosed
US-5532359-A FUNGICIDES GENENTECH, INC. (US) 1996-07-02 US disclosed
EP-0698015-A1 PREPARATION OF N-CYANODITHIOIMINO-CARBONATES AND 3-MERCAPTO-5-AMINO-1H-1,2,4-TRIAZOLE GENENTECH, INC. (US) 1996-02-28 EP disclosed
WO-1994026723-A2 ras FARNESYL TRANSFERASE INHIBITORS GENENTECH, INC. (US) 1994-11-24 WO disclosed