Sugi Predict

Sugi Predict / Compounds / SCHEMBL30262143

SCHEMBL30262143

SCHEMBL30262143

CSCC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)CO)C(C)C)[C@@H](C)O)C(C)C)C(=O)O

nearest known ligand 0.60

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ RAMP3 O60896 15/20 0.56
▸ CALCR P30988 15/20 0.56
▸ GLP1R P43220 1/20 0.51
▸ GCGR P47871 1/20 0.51

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
SCHEMBL30432102 0.89 RAMP3 (0.61) RAMP3CALCR
SCHEMBL30432851 0.89 RAMP3 (0.60) RAMP3CALCR
SCHEMBL31255218 0.88 APLNR (0.57) RAMP3CALCRGLP1RGCGR
SCHEMBL30906538 0.87 RAMP3 (0.55) RAMP3CALCR
SCHEMBL30493544 0.87 APLNR (0.48) RAMP3CALCR
SCHEMBL30261962 0.86 RAMP3 (0.52) RAMP3CALCR
SCHEMBL31182981 0.85 NPY2R (0.59) CALCRGLP1R
SCHEMBL30906340 0.85 NPY2R (0.57) RAMP3CALCR
SCHEMBL29568619 0.85 APLNR (0.48) RAMP3CALCR
SCHEMBL29569098 0.85 APLNR (0.48) RAMP3CALCR

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
US-20230040544-A1 COMPOSITIONS AND METHODS FOR RESTORING AND MAINTAINING THE DYSTROPHIN-ASSOCIATED PROTEIN COMPLEX (DAPC) SAREPTA THERAPEUTICS, INC. 2023-02-09 — — US disclosed
Send feedback