SCHEMBL29634982

SCHEMBL29634982

C[C@@H](O)[C@H](N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)C1CCCCC1

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ PSMB5 P28074 4/20 0.48
▸ CDYL2 Q8N8U2 1/20 0.47
▸ CDYL Q9Y232 1/20 0.47
▸ BACE1 P56817 6/20 0.43
▸ USP30 Q70CQ3 1/20 0.42
▸ STAT3 P40763 1/20 0.41

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
SCHEMBL29600734 0.83 CALCRL (0.51) PSMB5CDYL2CDYLBACE1STAT3
SCHEMBL29674863 0.80 BACE1 (0.49) BACE1
SCHEMBL30558305 0.75 NPY4R (0.51) BACE1
SCHEMBL31720970 0.74 BACE1 (0.65) BACE1
SCHEMBL17732675 0.74 BACE1 (0.56) BACE1
SCHEMBL31474502 0.74 OPRM1 (0.53) BACE1
SCHEMBL30735528 0.74 MME (0.57) —
SCHEMBL233444 0.74 MME (0.60) —
SCHEMBL31174325 0.74 MME (0.60) —
SCHEMBL233445 0.74 MME (0.60) —

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
EP-3997104-A1 COMPOUNDS COMPRISING A FIBROBLAST ACTIVATION PROTEIN LIGAND AND USE THEREOF 3B Pharmaceuticals GmbH (DE) 2022-05-18 — — EP disclosed
Send feedback