SCHEMBL8529219

SCHEMBL8529219

CC(O)C(NC(=O)C(N)Cc1ccc(O)cc1)C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SLC7A5 Q01650 1/20 0.58
OPRD1 P41143 9/20 0.57
OPRM1 P35372 6/20 0.57
YARS1 P54577 2/20 0.55
MME P08473 1/20 0.53
OPRK1 P41145 1/20 0.51
ERAP2 Q6P179 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
SCHEMBL9822736 1.00 SLC7A5 (0.58) SLC7A5OPRD1OPRM1YARS1MME
SCHEMBL30309232 1.00 SLC7A5 (0.58) SLC7A5OPRD1OPRM1YARS1MME
SCHEMBL8529222 1.00 SLC7A5 (0.58) SLC7A5OPRD1OPRM1YARS1MME
SCHEMBL30520377 0.95 OPRD1 (0.55) SLC7A5OPRD1OPRM1YARS1MME
SCHEMBL30017206 0.92 OPRD1 (0.62) SLC7A5OPRD1OPRM1YARS1MME
SCHEMBL30839485 0.92 OPRD1 (0.64) SLC7A5OPRD1OPRM1YARS1OPRK1
SCHEMBL31193449 0.92 OPRD1 (0.52) SLC7A5OPRD1OPRM1YARS1MME
SCHEMBL30839484 0.92 OPRD1 (0.64) SLC7A5OPRD1OPRM1YARS1OPRK1
SCHEMBL29823718 0.91 OPRD1 (0.70) OPRD1OPRM1MMEOPRK1
SCHEMBL22872688 0.90 ERAP2 (0.52) SLC7A5OPRD1OPRM1YARS1OPRK1

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
CN-114164134-B Bifidobacterium longum subspecies longum with functions of preventing and relieving colitis symptoms and application thereof 东北农业大学 2023-03-03 CN disclosed
CN-114164134-A Bifidobacterium longum subspecies longum with functions of preventing and relieving colitis symptoms and application thereof 东北农业大学 2022-03-11 CN disclosed
US-7214321-B2 Adsorption method and ligands GE HEALTHCARE BIO-SCIENCES AB (SE) 2007-05-08 US disclosed
US-7214321-B2 Adsorption method and ligands GE HEALTHCARE BIO-SCIENCES AB (SE) 2007-05-08 US disclosed
EP-0885899-A1 Method for obtaining peptide fragments by use of fluorinated organic acids SEIKO INSTRUMENTS INC. (JP) 1998-12-23 EP disclosed