SCHEMBL31425416

SCHEMBL31425416

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

nearest known ligand 0.59

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ ENPEP Q07075 17/20 0.59
▸ BACE1 P56817 3/20 0.50
▸ CTSD P07339 1/20 0.48

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
SCHEMBL30876822 0.92 ENPEP (0.70) ENPEPBACE1
SCHEMBL29641759 0.91 BACE1 (0.55) ENPEPBACE1CTSD
SCHEMBL30076058 0.90 ENPEP (0.58) ENPEPBACE1
SCHEMBL29461683 0.90 ENPEP (0.67) ENPEPBACE1
SCHEMBL29891984 0.89 BACE1 (0.48) ENPEPBACE1CTSD
SCHEMBL29598573 0.89 ENPEP (0.51) ENPEP
SCHEMBL29777901 0.86 PTPN1 (0.51) ENPEPBACE1CTSD
SCHEMBL30799805 0.86 PTPN1 (0.51) ENPEPBACE1CTSD
SCHEMBL29641684 0.86 BACE1 (0.57) ENPEPBACE1
SCHEMBL9451605 0.86 ENPEP (0.54) ENPEPBACE1CTSD

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-2025019599-A2 BIFUNCTIONAL KINASE BINDING COMPOUNDS AND USES THEREOF PHOTYS THERAPEUTICS, INC. (US) 2025-01-23 — — WO disclosed
Send feedback