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Sugi Predict / Compounds / SCHEMBL29454666

SCHEMBL29454666

SCHEMBL29454666

CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(C)C

nearest known ligand 0.75

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ GLP1R P43220 17/20 0.75
▸ ECE1 P42892 1/20 0.75
▸ MUS81 Q96NY9 1/20 0.75
▸ RXFP1 Q9HBX9 1/20 0.70
▸ CCKBR P32239 1/20 0.69
▸ PTH1R Q03431 1/20 0.69
▸ GCGR P47871 1/20 0.68
▸ GIPR P48546 1/20 0.68
▸ NR3C1 P04150 1/20 0.68

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
SCHEMBL30495632 0.94 GLP1R (0.69) GLP1RECE1MUS81CCKBRPTH1R
SCHEMBL29693515 0.94 GLP1R (0.72) GLP1RECE1MUS81RXFP1CCKBR
SCHEMBL29942531 0.94 GLP1R (0.78) GLP1RECE1MUS81CCKBRGCGR
SCHEMBL30005503 0.94 GLP1R (0.77) GLP1RECE1MUS81CCKBRGCGR
SCHEMBL30272000 0.94 GLP1R (0.72) GLP1RECE1MUS81RXFP1CCKBR
SCHEMBL31453802 0.94 GLP1R (0.72) GLP1RECE1MUS81RXFP1CCKBR
SCHEMBL30431337 0.94 GLP1R (0.70) GLP1RECE1MUS81CCKBRPTH1R
SCHEMBL31182990 0.93 GLP1R (0.70) GLP1RECE1MUS81CCKBRPTH1R
SCHEMBL30721601 0.93 GLP1R (0.77) GLP1RECE1MUS81CCKBRNR3C1
SCHEMBL29634677 0.93 GLP1R (0.77) GLP1RECE1MUS81CCKBRNR3C1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240158450-A1 METHODS AND COMPOSITIONS FOR ANTIBODY-EVADING VIRUS VECTORS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2024-05-16 — — US disclosed
US-11840555-B2 Methods and compositions for antibody-evading virus vectors THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2023-12-12 — — US disclosed
US-20220089651-A1 METHODS AND COMPOSITIONS FOR ANTIBODY-EVADING VIRUS VECTORS UNIV NORTH CAROLINA CHAPEL HILL (US) 2022-03-24 — — US disclosed