SCHEMBL30607426

SCHEMBL30607426

CC[C@H](C)[C@H](NC(=O)[C@H](CCSC)NC(=O)[C@@H](N)CC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CS)C(=O)N[C@@H](CO)C(=O)O)C(C)C

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ BACE1 P56817 1/20 0.45
▸ PTH1R Q03431 10/20 0.45
▸ RXFP1 Q9HBX9 1/20 0.43
▸ VIPR1 P32241 1/20 0.42
▸ FNTA P49354 3/20 0.40
▸ FNTB P49356 3/20 0.40

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
SCHEMBL30712785 0.92 PTH1R (0.52) BACE1PTH1RRXFP1VIPR1
SCHEMBL30449891 0.90 PTH1R (0.54) BACE1PTH1RRXFP1VIPR1
SCHEMBL30433492 0.87 PTH1R (0.57) PTH1RRXFP1VIPR1
SCHEMBL29805487 0.86 BACE1 (0.44) BACE1PTH1RRXFP1VIPR1FNTA
SCHEMBL29473681 0.85 VIPR1 (0.54) PTH1RRXFP1VIPR1
SCHEMBL29473651 0.84 VIPR1 (0.53) PTH1RRXFP1VIPR1
SCHEMBL29473696 0.84 VIPR1 (0.52) PTH1RRXFP1VIPR1
SCHEMBL29972934 0.84 VIPR1 (0.48) BACE1RXFP1VIPR1
SCHEMBL30912343 0.84 IL23R (0.41) BACE1VIPR1
SCHEMBL30339774 0.84 BACE1 (0.45) BACE1PTH1RRXFP1VIPR1

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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