SCHEMBL8526147

SCHEMBL8526147

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

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PDCD1LG2 Q9BQ51 2/20 0.48
CD274 Q9NZQ7 2/20 0.48
MME P08473 2/20 0.42
DPP4 P27487 1/20 0.39
DPP8 Q6V1X1 1/20 0.39
DPP9 Q86TI2 1/20 0.39
CA2 P00918 2/20 0.38
CA1 P00915 1/20 0.38
VSIR Q9H7M9 2/20 0.38
BHMT Q93088 1/20 0.37
ENPEP Q07075 5/20 0.36

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
SCHEMBL5053902 1.00 PDCD1LG2 (0.48) PDCD1LG2CD274MMEDPP4DPP8
SCHEMBL8526326 1.00 PDCD1LG2 (0.48) PDCD1LG2CD274MMEDPP4DPP8
SCHEMBL30462197 0.94 PDCD1LG2 (0.44) PDCD1LG2CD274MMEDPP4DPP8
SCHEMBL29599569 0.89 ENPEP (0.50) ENPEP
SCHEMBL29867109 0.89 PDCD1LG2 (0.50) PDCD1LG2CD274MMEVSIR
SCHEMBL31319509 0.88 OPRM1 (0.46) PDCD1LG2CD274MME
SCHEMBL8528144 0.88 CD274 (0.57) PDCD1LG2CD274MMEDPP4DPP8
SCHEMBL29572257 0.88 CD274 (0.57) PDCD1LG2CD274MMEDPP4DPP8
SCHEMBL29572216 0.88 CD274 (0.57) PDCD1LG2CD274MMEDPP4DPP8
SCHEMBL5998197 0.88 CD274 (0.57) PDCD1LG2CD274MMEDPP4DPP8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240241107-A1 SERUM METABOLOMICS RELATED TO CHIMERIC ANTIGEN RECEPTOR (CAR) T-CELL THERAPY BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2024-07-18 US disclosed
CN-117915926-A Serometabonomics associated with Chimeric Antigen Receptor (CAR) T cell therapy 得克萨斯州大学系统董事会 2024-04-19 CN disclosed
EP-4333860-A1 SERUM METABOLOMICS RELATED TO CHIMERIC ANTIGEN RECEPTOR (CAR) T-CELL THERAPY Board of Regents, The University of Texas System (US) 2024-03-13 EP disclosed
US-20230358751-A1 METHODS FOR THE DETECTION AND TREATMENT OF PROSTATE CANCER BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM 2023-11-09 US disclosed
WO-2022236131-A1 SERUM METABOLOMICS RELATED TO CHIMERIC ANTIGEN RECEPTOR (CAR) T-CELL THERAPY BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2022-11-10 WO disclosed
EP-0885899-A1 Method for obtaining peptide fragments by use of fluorinated organic acids SEIKO INSTRUMENTS INC. (JP) 1998-12-23 EP disclosed