SCHEMBL31494982

SCHEMBL31494982

CC(C)C[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1CCCCN1)C(C)C)C(=O)NO

nearest known ligand 0.64

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ GRPR P30550 18/20 0.64
▸ NMBR P28336 2/20 0.57

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
SCHEMBL30628980 0.96 GRPR (0.64) GRPRNMBR
SCHEMBL31494986 0.96 GRPR (0.60) GRPRNMBR
SCHEMBL29484955 0.92 GRPR (0.64) GRPRNMBR
SCHEMBL31494989 0.92 GRPR (0.62) GRPRNMBR
SCHEMBL30628976 0.92 GRPR (0.59) GRPRNMBR
SCHEMBL31223171 0.92 GRPR (0.57) GRPRNMBR
SCHEMBL31223153 0.91 GRPR (0.58) GRPRNMBR
SCHEMBL38660949 0.91 GRPR (0.57) GRPRNMBR
SCHEMBL30628965 0.91 GRPR (0.59) GRPRNMBR
SCHEMBL30629009 0.90 GRPR (0.54) GRPRNMBR

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-2025054727-A1 RADIOLABELED COMPOUNDS FOR IN VIVO IMAGING OF GASTRIN-RELEASING PEPTIDE RECEPTOR (GRPR) AND TREATMENT OF GRPR-RELATED DISORDERS PROVINCIAL HEALTH SERVICES AUTHORITY (CA) 2025-03-20 — — WO disclosed
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