SCHEMBL30952344

SCHEMBL30952344

CC[C@H](C)[C@H](NC(=O)COCCOCCN)C(=O)N[C@@H](CS)C(=O)N[C@H](C(=O)N[C@@H](Cc1cn(C)c2ccccc12)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CS)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(C)C

nearest known ligand 0.61

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ GLP1R P43220 20/20 0.61

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
SCHEMBL29489377 0.98 GLP1R (0.60) GLP1R
SCHEMBL29434536 0.91 GLP1R (0.55) GLP1R
SCHEMBL29489383 0.91 GLP1R (0.59) GLP1R
SCHEMBL29434617 0.90 GLP1R (0.55) GLP1R
SCHEMBL30216222 0.89 GLP1R (0.52) GLP1R
SCHEMBL30063985 0.86 GLP1R (0.54) GLP1R
SCHEMBL29484313 0.85 NPBWR1 (0.55) GLP1R
SCHEMBL29740501 0.85 GLP1R (0.59) GLP1R
SCHEMBL29871710 0.84 CTSL (0.53) GLP1R
SCHEMBL29670477 0.84 NPBWR1 (0.56) GLP1R

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
CN-118217402-A Combination therapy for C3 inhibition 阿佩利斯制药有限公司 2024-06-21 — — CN disclosed
Send feedback