SCHEMBL30607352

SCHEMBL30607352

CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CN)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O)C(C)C)C(C)C)[C@@H](C)O)C(C)C

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ GLP1R P43220 6/20 0.57
▸ GCGR P47871 1/20 0.57
▸ GIPR P48546 1/20 0.57
▸ BACE1 P56817 5/20 0.56
▸ BACE2 Q9Y5Z0 3/20 0.53
▸ TFPI P10646 1/20 0.53
▸ VIPR1 P32241 2/20 0.51
▸ IL23R Q5VWK5 1/20 0.51
▸ VIPR2 P41587 2/20 0.50
▸ CCKBR P32239 1/20 0.49

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
SCHEMBL31688316 0.90 GLP1R (0.56) GLP1RGCGRGIPRBACE1BACE2
SCHEMBL30906345 0.89 BACE1 (0.65) GLP1RGCGRGIPRBACE1BACE2
SCHEMBL31182625 0.89 BACE1 (0.57) GLP1RGCGRGIPRBACE1BACE2
SCHEMBL30648478 0.88 GLP1R (0.57) GLP1RGCGRGIPRBACE1BACE2
SCHEMBL31182935 0.88 TFPI (0.62) GLP1RGCGRGIPRBACE1TFPI
SCHEMBL30607491 0.88 VIPR2 (0.56) GLP1RGCGRGIPRBACE1VIPR1
SCHEMBL31683306 0.87 GLP1R (0.57) GLP1RGCGRGIPRBACE1BACE2
SCHEMBL30880889 0.87 BACE1 (0.54) GLP1RGCGRGIPRBACE1BACE2
SCHEMBL30880910 0.86 BACE1 (0.55) GLP1RGCGRGIPRBACE1BACE2
SCHEMBL30428639 0.86 BACE1 (0.56) GLP1RGCGRGIPRBACE1BACE2

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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