SCHEMBL31410843

SCHEMBL31410843

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

nearest known ligand 0.58

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ FOLH1 Q04609 7/20 0.58
▸ BACE1 P56817 7/20 0.50
▸ PTPN1 P18031 3/20 0.50
▸ BACE2 Q9Y5Z0 2/20 0.50
▸ CTSD P07339 1/20 0.49
▸ GNPAT O15228 1/20 0.48
▸ NAALAD2 Q9Y3Q0 1/20 0.47

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
SCHEMBL30436991 0.99 FOLH1 (0.60) FOLH1BACE1PTPN1BACE2CTSD
SCHEMBL30128626 0.99 FOLH1 (0.60) FOLH1BACE1PTPN1BACE2CTSD
SCHEMBL29606046 0.99 FOLH1 (0.60) FOLH1BACE1PTPN1BACE2CTSD
SCHEMBL30722468 0.94 FOLH1 (0.51) FOLH1BACE1PTPN1BACE2CTSD
SCHEMBL29655247 0.93 FOLH1 (0.60) FOLH1BACE1PTPN1BACE2CTSD
SCHEMBL30193377 0.93 FOLH1 (0.63) FOLH1BACE1BACE2NAALAD2
SCHEMBL30553677 0.93 FOLH1 (0.63) FOLH1BACE1BACE2NAALAD2
SCHEMBL4218269 0.93 FOLH1 (0.63) FOLH1BACE1BACE2NAALAD2
SCHEMBL4218275 0.93 FOLH1 (0.63) FOLH1BACE1BACE2NAALAD2
SCHEMBL30814868 0.92 FOLH1 (0.61) FOLH1BACE1BACE2CTSDNAALAD2

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
WO-2025002589-A1 TISSUE EXTRACELLULAR PEPTIDE PATTERNS DEDICATED FOR GENERATION OF ANTI-CANCER VACCINES AGAINST SALIVARY GLAND TUMOR, IDENTIFICATION AND ISOLATION OF SALIVARY GLAND TUMOR SPECIFIC T CELLS IN HUMANS Uniwersytet Gdański (PL) 2025-01-02 — — WO claimed
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