SCHEMBL9763734

SCHEMBL9763734

N[C@@H](CS)C(=O)OC(=O)CC(=O)OC(=O)[C@@H](N)CS

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 1/20 0.46
SLC7A11 Q9UPY5 1/20 0.46
ENPEP Q07075 5/20 0.32
MGAM O43451 1/20 0.32
GAA P10253 1/20 0.32
SI P14410 1/20 0.32
MGAM2 Q2M2H8 1/20 0.32
TSHR P16473 1/20 0.32
HSD17B10 Q99714 1/20 0.32
ANPEP P15144 2/20 0.31
MMP2 P08253 1/20 0.31

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
SCHEMBL2873837 0.86 PTGS1 (0.46) PTGS1SLC7A11ENPEPANPEP
SCHEMBL7927272 0.86 PTGS1 (0.46) PTGS1SLC7A11ENPEPANPEP
SCHEMBL4743441 0.86 PTGS1 (0.46) PTGS1SLC7A11ENPEPTSHRHSD17B10
SCHEMBL20657045 0.85 PTGS1 (0.55) PTGS1SLC7A11ENPEPANPEPMMP2
SCHEMBL1964879 0.85 PTGS1 (0.55) PTGS1SLC7A11ENPEPANPEPMMP2
SCHEMBL19511523 0.84 PTGS1 (0.44) PTGS1SLC7A11ENPEPTSHRHSD17B10
SCHEMBL5149928 0.84 PTGS1 (0.44) PTGS1SLC7A11ENPEPANPEP
SCHEMBL5688404 0.84 PTGS1 (0.44) PTGS1SLC7A11ENPEPMGAMGAA
SCHEMBL361160 0.84 PTGS1 (0.44) PTGS1SLC7A11ENPEPANPEP
Hydrochloric Acid SCHEMBL11053789 0.83 PTGS1 (0.52) PTGS1SLC7A11ENPEPANPEPMMP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4986999-A PRODUCT FROM ENZYMATIC HYDROLYSIS OF PROTEINS EXTRACTED FROM FISH OR MEATS NIHON BUSSAN KABUSHIKI KAISHA (JP) 1991-01-22 US disclosed