SCHEMBL31571919

SCHEMBL31571919

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

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ NOD1 Q9Y239 5/20 0.44
▸ GLO1 Q04760 1/20 0.40
▸ KMT2A Q03164 2/20 0.39
▸ PTGS1 P23219 1/20 0.39
▸ GSTK1 Q9Y2Q3 1/20 0.39
▸ FOLH1 Q04609 3/20 0.39
▸ DPP4 P27487 1/20 0.38
▸ DPP8 Q6V1X1 1/20 0.38
▸ DPP9 Q86TI2 1/20 0.38
▸ ECE1 P42892 2/20 0.38
▸ CA2 P00918 3/20 0.38
▸ CA1 P00915 2/20 0.38
▸ ALOX15 P16050 1/20 0.38
▸ BLM P54132 1/20 0.38
▸ PMP22 Q01453 1/20 0.38
▸ BMP1 P13497 1/20 0.37
▸ FNTA P49354 1/20 0.36
▸ FNTB P49356 1/20 0.36
▸ PGGT1B P53609 1/20 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
SCHEMBL10437934 0.96 NOD1 (0.44) NOD1GLO1KMT2APTGS1GSTK1
SCHEMBL10437933 0.96 NOD1 (0.44) NOD1GLO1KMT2APTGS1GSTK1
SCHEMBL258819 0.93 NOD1 (0.42) NOD1GLO1KMT2APTGS1GSTK1
SCHEMBL30563321 0.92 NOD1 (0.41) NOD1GLO1KMT2APTGS1GSTK1
SCHEMBL7614754 0.89 NOD1 (0.52) NOD1GLO1KMT2APTGS1GSTK1
SCHEMBL7614745 0.89 NOD1 (0.52) NOD1GLO1KMT2APTGS1GSTK1
SCHEMBL4221433 0.85 NOD1 (0.47) NOD1KMT2AFOLH1DPP4DPP8
SCHEMBL2492939 0.85 NOD1 (0.47) NOD1KMT2AFOLH1DPP4DPP8
SCHEMBL6600219 0.85 NOD1 (0.47) NOD1KMT2AFOLH1DPP4DPP8
SCHEMBL8430995 0.85 NOD1 (0.47) NOD1KMT2AFOLH1DPP4DPP8

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
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