SCHEMBL24360271

SCHEMBL24360271

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

nearest known ligand 0.75

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 1/20 0.75
GSTK1 Q9Y2Q3 1/20 0.75
NOD1 Q9Y239 13/20 0.56
GLO1 Q04760 1/20 0.52
FNTA P49354 2/20 0.47
FNTB P49356 2/20 0.47
PGGT1B P53609 1/20 0.47
FOLH1 Q04609 1/20 0.43

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
SCHEMBL24359868 1.00 PTGS1 (0.75) PTGS1GSTK1NOD1GLO1FNTA
SCHEMBL13259629 0.92 PTGS1 (0.76) PTGS1GSTK1NOD1GLO1FNTA
SCHEMBL24668402 0.89 PTGS1 (0.71) PTGS1GSTK1NOD1GLO1FNTA
SCHEMBL13747027 0.88 NOD1 (0.58) PTGS1GSTK1NOD1GLO1FOLH1
SCHEMBL928708 0.88 PTGS1 (0.79) PTGS1GSTK1NOD1GLO1FNTA
SCHEMBL4408402 0.87 PTGS1 (0.73) PTGS1GSTK1NOD1GLO1FNTA
SCHEMBL929035 0.87 PTGS1 (0.72) PTGS1GSTK1NOD1GLO1FNTA
Glutathione SCHEMBL17629816 0.87 PTGS1 (0.90) PTGS1GSTK1NOD1GLO1FNTA
Glutathione SCHEMBL28101167 0.87 PTGS1 (0.90) PTGS1GSTK1NOD1GLO1FNTA
Propionamide SCHEMBL27610994 0.87 PTGS1 (0.68) PTGS1GSTK1NOD1GLO1FNTA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022084738-A2 COMPOUNDS AND METHODS FOR THE TREATMENT OF OCULAR DISORDERS Azura Ophthalmics Ltd. (IL) 2022-04-28 WO disclosed
WO-2022084747-A1 COMPOUNDS AND METHODS FOR THE TREATMENT OF OCULAR DISORDERS Azura Ophthalmics Ltd. (IL) 2022-04-28 WO disclosed
WO-2022084739-A1 COMPOUNDS AND METHODS FOR THE TREATMENT OF OCULAR DISORDERS Azura Ophthalmics Ltd. (IL) 2022-04-28 WO disclosed