SCHEMBL8801124

SCHEMBL8801124

CCOC(=O)CN1C(=O)C(NC(=O)OC(C)(C)C)C=C(c2ccccc2F)c2cc(Cl)ccc21

nearest known ligand 0.51

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CCKBR P32239 11/20 0.51
CCKAR P32238 6/20 0.51
HTT P42858 2/20 0.43
MAPT P10636 1/20 0.43
TSHR P16473 1/20 0.43
USP2 O75604 1/20 0.38

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
SCHEMBL8800433 0.90 CCKBR (0.46) CCKBRCCKAR
SCHEMBL8801355 0.82 HTT (0.43) CCKBRCCKARHTTMAPTTSHR
SCHEMBL8804138 0.81 CCKBR (0.42) CCKBRCCKAR
SCHEMBL8801349 0.75 HTT (0.45) CCKBRCCKARHTTMAPTTSHR
SCHEMBL8537024 0.75 CCKBR (0.72) CCKBRCCKAR
SCHEMBL8537020 0.75 CCKBR (0.72) CCKBRCCKAR
SCHEMBL8669318 0.74 CHRM1 (0.53) CCKBRCCKAR
SCHEMBL8804134 0.73 CCKBR (0.41) CCKBRCCKARMAPT
SCHEMBL8800940 0.73 CCKBR (0.64) CCKBRCCKARMAPT
SCHEMBL11118972 0.73 NFKB1 (0.46) CCKBRCCKAR

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-0763537-A2 Non-peptidyl Ras farnesyl transferase inhibitors GENENTECH, INC. (US) 1997-03-19 EP 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