SCHEMBL29736307

SCHEMBL29736307

CC(C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCCNC(=N)N)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ C5AR1 P21730 1/20 0.52
▸ GLP1R P43220 15/20 0.50
▸ SCTR P47872 1/20 0.50
▸ KEAP1 Q14145 1/20 0.46
▸ PRMT1 Q99873 1/20 0.45
▸ GCGR P47871 1/20 0.44

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
SCHEMBL17887955 0.92 C5AR1 (0.47) C5AR1GLP1RSCTRKEAP1PRMT1
SCHEMBL31496391 0.91 C5AR1 (0.49) C5AR1GLP1RSCTRKEAP1
SCHEMBL30680486 0.90 NPY4R (0.48) C5AR1GLP1RSCTRKEAP1
SCHEMBL30645268 0.90 C5AR1 (0.42) C5AR1GLP1RSCTRKEAP1PRMT1
SCHEMBL31410887 0.87 GLP1R (0.57) GLP1RSCTRKEAP1
SCHEMBL30804657 0.86 GLP1R (0.60) GLP1RSCTRGCGR
SCHEMBL29736147 0.86 KEAP1 (0.47) C5AR1GLP1RSCTRKEAP1
SCHEMBL30645275 0.86 GLP1R (0.44) GLP1RSCTR
SCHEMBL30645274 0.86 GLP1R (0.48) GLP1RSCTR
SCHEMBL30645272 0.85 NPY4R (0.49) C5AR1GLP1RSCTR

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-11365217-B2 Peptides for treating telomere dysfunction-associated diseases and uses thereof HANGZHOU DUANLI BIOTECHNOLOGY COMPANY LIMITED (CN) 2022-06-21 — — US disclosed
Send feedback