SCHEMBL6033432

SCHEMBL6033432

CC(CC(=O)Cc1ccccc1)C[C@H](N)C(=O)O

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SLC1A1 P43005 4/20 0.51
SLC1A3 P43003 2/20 0.51
SLC1A2 P43004 2/20 0.51
SLC7A5 Q01650 3/20 0.50
ALPI P09923 1/20 0.50
PKM P14618 1/20 0.50
PTGS1 P23219 1/20 0.50
XIAP P98170 1/20 0.50
ANPEP P15144 1/20 0.47
RNPEP Q9H4A4 1/20 0.47
DNPEP Q9ULA0 1/20 0.47
GRIK1 P39086 3/20 0.47
GRM2 Q14416 1/20 0.44
GRM3 Q14832 1/20 0.44
GRIK2 Q13002 1/20 0.43
TSHR P16473 1/20 0.42
IDO1 P14902 1/20 0.41
LTA4H P09960 1/20 0.41

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
SCHEMBL27278334 0.87 ALPI (0.60) SLC1A1SLC1A3SLC1A2SLC7A5ALPI
SCHEMBL29179537 0.85 PNMT (0.47) SLC1A1SLC1A3SLC1A2SLC7A5GRIK1
SCHEMBL23249510 0.82 GRIK1 (0.56) SLC1A1SLC1A3SLC1A2SLC7A5ALPI
SCHEMBL27170852 0.80 SLC7A5 (0.62) SLC1A1SLC1A3SLC1A2SLC7A5ALPI
SCHEMBL9341151 0.80 SLC7A5 (0.62) SLC1A1SLC1A3SLC1A2SLC7A5ALPI
SCHEMBL7053196 0.79 ITGB1 (0.57) SLC1A1SLC1A3SLC1A2
SCHEMBL8530260 0.79 SLC1A1 (0.56) SLC1A1SLC1A3SLC1A2SLC7A5ALPI
SCHEMBL108380 0.78 TSHR (0.49) TSHR
SCHEMBL4117169 0.78 SLC15A1 (0.59) SLC1A1SLC1A3SLC1A2SLC7A5ALPI
SCHEMBL7303521 0.78 SLC15A1 (0.59) SLC1A1SLC1A3SLC1A2SLC7A5ALPI

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7033781-B1 Whole cell engineering by mutagenizing a substantial portion of a starting genome, combining mutations, and optionally repeating DIVERSA CORPORATION (US) 2006-04-25 US disclosed
US-20050124010-A1 Whole cell engineering by mutagenizing a substantial portion of a starting genome combining mutations and optionally repeating DIVERSA CORPORATION 2005-06-09 US disclosed
EP-1415160-A2 WHOLE CELL ENGINEERING BY MUTAGENIZING A SUBSTANTIAL PORTION OF A STARTING GENOME, COMBINING MUTATIONS, AND OPTIONALLY REPEATING DIVERSA CORPORATION (US) 2004-05-06 EP disclosed
US-20040077090-A1 Whole cell engineering by mutagenizing a substantial portion of a starting genome, combining mutations, and optionally repeating SHORT JAY M (US) 2004-04-22 US disclosed
EP-1294869-A2 WHOLE CELL ENGINEERING BY MUTAGENIZING A SUBSTANTIAL PORTION OF A STARTING GENOME, COMBINING MUTATIONS, AND OPTIONALLY REPEATING DIVERSA CORPORATION (US) 2003-03-26 EP disclosed
WO-2002029032-A2 WHOLE CELL ENGINEERING BY MUTAGENIZING A SUBSTANTIAL PORTION OF A STARTING GENOME, COMBINING MUTATIONS, AND OPTIONALLY REPEATING DIVERSA CORPORATION (US) 2002-04-11 WO disclosed
WO-2001096551-A2 WHOLE CELL ENGINEERING BY MUTAGENIZING A SUBSTANTIAL PORTION OF A STARTING GENOME, COMBINING MUTATIONS, AND OPTIONALLY REPEATING DIVERSA CORPORATION (US) 2001-12-20 WO disclosed
US-6033823-A Mutated penicillin G acylase genes DSM SINOCHEM PHARMACEUTICALS NETHERLANDS B.V., (NL) 2000-03-07 US disclosed
EP-0775210-B1 MUTATED PENICILLIN G ACYLASE GENES DSM NV (NL) 2000-02-02 EP disclosed
EP-0906418-A4 1999-05-06 EP disclosed
EP-0906418-A1 METHODS AND COMPOSITIONS FOR CELLULAR AND METABOLIC ENGINEERING Maxygen, Inc. (US) 1999-04-07 EP disclosed
US-5891703-A Mutated penicillin G acylase genes GIST-HROCADES (NL) 1999-04-06 US disclosed
US-5695978-A CULTURE PRODUCT GIST-BROCADES, N.V. (NL) 1997-12-09 US disclosed
WO-1997035966-A1 METHODS AND COMPOSITIONS FOR CELLULAR AND METABOLIC ENGINEERING MAXYGEN, INC. (US) 1997-10-02 WO disclosed
EP-0775210-A1 MUTATED PENICILLIN G ACYLASE GENES GIST-BROCADES B.V. (NL) 1997-05-28 EP disclosed
WO-1996005318-A1 MUTATED PENICILLIN G ACYLASE GENES GIST-BROCADES B.V. (NL) 1996-02-22 WO disclosed
EP-0453047-B1 Penicillin G acylase, a gene encoding the same and a method for the production of this enzyme GIST BROCADES NV (NL) 1995-07-05 EP disclosed
US-5168048-A Genetic engineering of Alcaligenes GIST-BROCADES NV (NL) 1992-12-01 US disclosed
EP-0453047-A1 Penicillin G acylase, a gene encoding the same and a method for the production of this enzyme GIST-BROCADES N.V. (NL) 1991-10-23 EP disclosed