SCHEMBL31430091

SCHEMBL31430091

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

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ GLO1 Q04760 1/20 0.41
▸ PTGS1 P23219 1/20 0.40
▸ GSTK1 Q9Y2Q3 1/20 0.40
▸ TFPI P10646 1/20 0.39
▸ KEAP1 Q14145 1/20 0.38
▸ NPY4R P50391 7/20 0.38
▸ NPY1R P25929 5/20 0.38
▸ NPY2R P49146 5/20 0.38
▸ NPY5R Q15761 5/20 0.38
▸ EGFR P00533 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
SCHEMBL31338675 0.96 NPY4R (0.41) GLO1PTGS1GSTK1TFPIKEAP1
SCHEMBL31430114 0.91 TFPI (0.41) GLO1TFPIKEAP1NPY4RNPY1R
SCHEMBL31338673 0.91 TFPI (0.41) GLO1TFPIKEAP1NPY4RNPY1R
SCHEMBL30903470 0.88 NPY4R (0.39) PTGS1GSTK1NPY4RNPY1RNPY2R
SCHEMBL29590332 0.88 PTGS1 (0.43) GLO1PTGS1GSTK1NPY4RNPY1R
SCHEMBL30974097 0.87 GLO1 (0.41) GLO1PTGS1GSTK1TFPIKEAP1
SCHEMBL30943802 0.87 NOD1 (0.43) GLO1PTGS1GSTK1KEAP1NPY4R
SCHEMBL8000021 0.86 NOD1 (0.43) GLO1PTGS1GSTK1KEAP1NPY4R
SCHEMBL8000016 0.86 NOD1 (0.43) GLO1PTGS1GSTK1KEAP1NPY4R
SCHEMBL29880339 0.86 NOD1 (0.44) GLO1PTGS1GSTK1KEAP1NPY4R

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4739336-A2 METHOD FOR IMMOBILIZATION OF PROTEINS Perseo Pharma AG (CH) 2026-05-13 — — EP disclosed
WO-2025008476-A2 METHOD FOR IMMOBILIZATION OF PROTEINS PERSEO PHARMA AG (CH) 2025-01-09 — — WO disclosed
Send feedback