SCHEMBL30607454

SCHEMBL30607454

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

nearest known ligand 0.62

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ RXFP1 Q9HBX9 4/20 0.53
▸ CCKBR P32239 1/20 0.53
▸ GLP1R P43220 1/20 0.53
▸ PTH1R Q03431 2/20 0.53
▸ VIPR1 P32241 3/20 0.53
▸ VIPR2 P41587 4/20 0.52
▸ CALCR P30988 1/20 0.50

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
SCHEMBL30433492 0.92 PTH1R (0.57) RXFP1CCKBRGLP1RPTH1RVIPR1
SCHEMBL30179580 0.92 VIPR1 (0.53) RXFP1GLP1RPTH1RVIPR1VIPR2
SCHEMBL30432139 0.92 RXFP1 (0.58) RXFP1CCKBRGLP1RPTH1RVIPR1
SCHEMBL30463856 0.91 RXFP1 (0.59) RXFP1CCKBRGLP1RPTH1RVIPR1
SCHEMBL30432137 0.90 PTH1R (0.51) RXFP1CCKBRGLP1RPTH1RVIPR1
SCHEMBL30176490 0.90 VIPR1 (0.57) RXFP1GLP1RPTH1RVIPR1VIPR2
SCHEMBL30432112 0.89 RXFP1 (0.60) RXFP1CCKBRGLP1RPTH1RVIPR1
SCHEMBL30495796 0.89 RXFP1 (0.59) RXFP1CCKBRGLP1RPTH1RVIPR1
SCHEMBL31182832 0.89 RXFP1 (0.61) RXFP1CCKBRGLP1RPTH1RVIPR1
SCHEMBL30712928 0.89 TFPI (0.56) RXFP1CCKBRGLP1RPTH1RVIPR1

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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