SCHEMBL31571920

SCHEMBL31571920

N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CS)C(=O)NCC(=O)O

nearest known ligand 0.59

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 1/20 0.59
GSTK1 Q9Y2Q3 1/20 0.59
GLO1 Q04760 1/20 0.44
FOLH1 Q04609 1/20 0.42
BMP1 P13497 1/20 0.42
ENPEP Q07075 6/20 0.41
ANPEP P15144 3/20 0.41
EGFR P00533 1/20 0.38
DPP4 P27487 1/20 0.37
DPP8 Q6V1X1 1/20 0.37
DPP9 Q86TI2 1/20 0.37

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
SCHEMBL29693286 0.92 GLO1 (0.49) PTGS1GSTK1GLO1FOLH1BMP1
SCHEMBL30974035 0.91 GLO1 (0.46) PTGS1GSTK1GLO1FOLH1BMP1
SCHEMBL30905697 0.90 PTGS1 (0.61) PTGS1GSTK1GLO1
SCHEMBL30438147 0.89 PTGS1 (0.57) PTGS1GSTK1GLO1FOLH1BMP1
SCHEMBL30438215 0.89 PTGS1 (0.57) PTGS1GSTK1GLO1FOLH1BMP1
SCHEMBL30069089 0.88 GLO1 (0.44) PTGS1GSTK1GLO1FOLH1BMP1
SCHEMBL29892438 0.88 PTGS1 (0.58) PTGS1GSTK1GLO1FOLH1BMP1
SCHEMBL931787 0.88 PTGS1 (0.70) PTGS1GSTK1GLO1FOLH1BMP1
SCHEMBL209654 0.88 PTGS1 (0.70) PTGS1GSTK1GLO1FOLH1BMP1
SCHEMBL29682736 0.87 GLO1 (0.44) PTGS1GSTK1GLO1BMP1EGFR

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
CN-119932007-A Immobilized enzyme, preparation method and application thereof 天津凯莱英生物科技有限公司 2025-05-06 CN disclosed