SCHEMBL31583875

SCHEMBL31583875

CC(C)C[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ NMUR2 Q9GZQ4 4/20 0.54
▸ NMUR1 Q9HB89 4/20 0.54
▸ KISS1R Q969F8 1/20 0.51
▸ SLC6A2 P23975 1/20 0.49
▸ F2 P00734 4/20 0.49

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
SCHEMBL29802631 0.89 SLC6A2 (0.60) SLC6A2
SCHEMBL30974302 0.89 SLC6A2 (0.50) NMUR2NMUR1SLC6A2
SCHEMBL31583750 0.87 REN (0.46) NMUR2NMUR1F2
SCHEMBL30692437 0.85 REN (0.51) NMUR2NMUR1SLC6A2F2
SCHEMBL31452908 0.85 SLC6A2 (0.57) SLC6A2F2
SCHEMBL29461562 0.85 F2 (0.46) NMUR2NMUR1KISS1RF2
SCHEMBL30785949 0.85 REN (0.52) NMUR2NMUR1SLC6A2F2
SCHEMBL31419999 0.84 NMUR2 (0.57) NMUR2NMUR1SLC6A2
SCHEMBL31276072 0.84 SLC6A2 (0.69) SLC6A2F2
SCHEMBL32665679 0.84 SLC6A2 (0.51) NMUR2NMUR1SLC6A2F2

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-2025105948-A1 [99MTC]TC-IPD-L1 AS A TETRADECAPEPTIDE RADIOPHARMACEUTICAL FOR DETECTING AND MONITORING THE OVEREXPRESSION OF THE PD-L1 PROTEIN INSTITUTO NACIONAL DE INVESTIGACIONES NUCLEARES (MX) 2025-05-22 — — WO disclosed
Send feedback