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Sugi Predict / Compounds / SCHEMBL30607395

SCHEMBL30607395

SCHEMBL30607395

CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(=O)O

nearest known ligand 0.60

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ GLP1R P43220 6/20 0.60
▸ CCKBR P32239 4/20 0.60
▸ F2 P00734 4/20 0.58
▸ KEAP1 Q14145 1/20 0.58
▸ GCGR P47871 2/20 0.58
▸ GIPR P48546 2/20 0.58
▸ CALCR P30988 4/20 0.57
▸ MAPK8 P45983 1/20 0.57
▸ MAPK9 P45984 1/20 0.57
▸ MAPK10 P53779 1/20 0.57
▸ NMBR P28336 2/20 0.57
▸ GRPR P30550 2/20 0.57
▸ NPY1R P25929 1/20 0.56
▸ NPY2R P49146 1/20 0.56
▸ NPY4R P50391 1/20 0.56
▸ NPY5R Q15761 1/20 0.56

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
SCHEMBL30658355 0.91 GLP1R (0.67) GLP1RCCKBRKEAP1GCGRGIPR
SCHEMBL31000927 0.90 NMBR (0.55) GLP1RCCKBRKEAP1GCGRCALCR
SCHEMBL31182593 0.90 F2 (0.66) GLP1RCCKBRF2CALCRNMBR
SCHEMBL29811075 0.88 NPY1R (0.61) GLP1RCCKBRKEAP1GCGRGIPR
SCHEMBL31182577 0.87 GLP1R (0.71) GLP1RCCKBRCALCRNMBRGRPR
SCHEMBL30648497 0.86 GLP1R (0.64) GLP1RCCKBR
SCHEMBL30903284 0.86 MAPK8 (0.60) GLP1RCCKBRKEAP1GCGRGIPR
SCHEMBL29743013 0.85 C5AR1 (0.59) GLP1RCCKBRKEAP1GCGRGIPR
SCHEMBL30726621 0.85 GLP1R (0.60) GLP1RCCKBRKEAP1GCGRCALCR
SCHEMBL30495677 0.85 NPY1R (0.72) GLP1RCCKBRGCGRGIPRCALCR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12383505-B2 Nanoparticle for the remodeling of cancer-associated fibroblasts UNIVERSITY OF SOUTH CAROLINA (US) 2025-08-12 — — US disclosed
US-20230310331-A1 NANOPARTICLE FOR THE REMODELING OF CANCER-ASSOCIATED FIBROBLASTS UNIVERSITY OF SOUTH CAROLINA (US) 2023-10-05 — — US disclosed
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