SCHEMBL2494142

SCHEMBL2494142

NC(=O)N1CCC[C@]1(C(=O)O)c1cccc2ccccc12

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SLC6A3 Q01959 6/20 0.40
SLC6A2 P23975 5/20 0.40
SLC6A4 P31645 4/20 0.40
CXCR5 P32302 1/20 0.35
KDM4E B2RXH2 2/20 0.35
KIF11 P52732 1/20 0.35
AVPR1A P37288 1/20 0.35
TMPRSS2 O15393 1/20 0.35
GAA P10253 1/20 0.35
SIGMAR1 Q99720 2/20 0.35
LMNA P02545 1/20 0.35
POLB P06746 1/20 0.35

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
SCHEMBL20446611 0.91 SLC6A3 (0.40) SLC6A3SLC6A2SLC6A4KDM4EGAA
SCHEMBL2008409 0.82 SLC6A3 (0.39) SLC6A3SLC6A2SLC6A4CXCR5KDM4E
SCHEMBL5734399 0.73 HSD11B1 (0.41) SLC6A4LMNA
SCHEMBL5763693 0.71 HDAC4 (0.42) KIF11GAA
SCHEMBL8112531 0.70 AKR1C1 (0.52) SLC6A3SLC6A2SLC6A4CXCR5KIF11
SCHEMBL5737569 0.69 OPRK1 (0.40)
SCHEMBL1097860 0.69 MEN1 (0.45) SLC6A3SLC6A2SLC6A4GAASIGMAR1
SCHEMBL697151 0.69 AKR1C1 (0.48) SLC6A3SLC6A2SLC6A4CXCR5KDM4E
SCHEMBL5736474 0.68 OPRM1 (0.36) SLC6A3SLC6A2SLC6A4KDM4EGAA
SCHEMBL6231574 0.68 SLC6A3 (0.44) SLC6A3SLC6A2SLC6A4KDM4EKIF11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1911839-B1 Peptide-forming enzyme gene, peptide-forming enzyme, and dipeptide producing method AJINOMOTO KK (JP) 2011-10-26 EP disclosed
US-7618796-B2 Peptide-forming enzyme gene, peptide-forming enzyme, and peptide producing method AJINOMOTO CO., INC. (JP) 2009-11-17 US disclosed
EP-1411116-B1 PEPTIDE SYNTHASE GENE, PEPTIDE SYNTHASE AND PROCESS FOR PRODUCING DIPEPTIDE AJINOMOTO KK (JP) 2008-04-23 EP disclosed
EP-1911839-A1 Peptide-forming enzyme gene, peptide-forming enzyme, and dipeptide producing method Ajinomoto Co., Inc. (JP) 2008-04-16 EP disclosed
US-7288388-B2 Peptide-forming enzyme gene, peptide-forming enzyme, and peptide producing method AJINOMOTO CO., INC. (JP) 2007-10-30 US disclosed
US-20070048838-A1 Peptide-forming enzyme gene, peptide-forming enzyme, and peptide producing method AJINOMOTO CO., INC (JP) 2007-03-01 US disclosed
US-20050037453-A1 Peptide-forming enzyme gene, peptide-forming enzyme, and peptide producing method AJINOMOTO CO. INC (JP) 2005-02-17 US disclosed
EP-1411116-A1 PEPTIDE SYNTHASE GENE, PEPTIDE SYNTHASE AND PROCESS FOR PRODUCING DIPEPTIDE Ajinomoto Co., Inc. (JP) 2004-04-21 EP disclosed