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Sugi Predict / Compounds / SCHEMBL30481568

SCHEMBL30481568

SCHEMBL30481568

CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCCN)C(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CS)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CS)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)O

nearest known ligand 0.66

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ NPY2R P49146 8/20 0.66
▸ NPY4R P50391 8/20 0.66
▸ NPY5R Q15761 8/20 0.66
▸ NPY1R P25929 6/20 0.66
▸ TFPI P10646 6/20 0.66
▸ CXCR4 P61073 4/20 0.64
▸ RAMP3 O60896 1/20 0.62
▸ CALCR P30988 1/20 0.62
▸ REN P00797 1/20 0.62

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
Sor-C13 SCHEMBL29926670 0.90 TFPI (0.67) NPY2RNPY4RNPY5RNPY1RTFPI
SCHEMBL31031455 0.87 KDM1A (0.65) NPY2RNPY4RNPY5RNPY1RTFPI
Isracidin SCHEMBL29668326 0.85 NPY2R (0.70) NPY2RNPY4RNPY5RNPY1RTFPI
SCHEMBL29778186 0.85 AGTR2 (0.77) NPY2RNPY4RNPY5RNPY1RTFPI
SCHEMBL31031546 0.85 KDM1A (0.67) NPY2RNPY4RNPY5RNPY1RTFPI
SCHEMBL29903316 0.85 NPY2R (0.64) NPY2RNPY4RNPY5RNPY1RTFPI
SCHEMBL29973299 0.84 TFPI (0.66) NPY2RNPY4RNPY5RNPY1RTFPI
SCHEMBL29542556 0.84 TFPI (0.70) NPY2RNPY4RNPY5RNPY1RTFPI
SCHEMBL4331434 0.84 NPY2R (0.75) NPY2RNPY4RNPY5RNPY1RTFPI
SCHEMBL29625796 0.84 KDM1A (0.66) NPY2RNPY4RNPY5RNPY1RTFPI

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250210128-A1 COMPUTER-IMPLEMENTED DESIGN OF PEPTIDE:RECEPTOR SIGNALING COMPLEXES FOR ENHANCED CHEMOTAXIS ECOLE POLYTECHNIQUE FEDERALE DE LAUSANNE (EPFL) (CH) 2025-06-26 — — US disclosed
US-20250041325-A1 LIPID-BASED COMPOSITIONS AND METHODS THEREOF UNITED STATES GOVERNMENT 2025-02-06 — — US disclosed
EP-4500532-A1 COMPUTER-IMPLEMENTED DESIGN OF PEPTIDE:RECEPTOR SIGNALING COMPLEXES FOR ENHANCED CHEMOTAXIS Ecole Polytechnique Fédérale de Lausanne EPFL-TTO (CH) 2025-02-05 — — EP disclosed
WO-2023186863-A1 COMPUTER-IMPLEMENTED DESIGN OF PEPTIDE:RECEPTOR SIGNALING COMPLEXES FOR ENHANCED CHEMOTAXIS ECOLE POLYTECHNIQUE FEDERALE DE LAUSANNE (EPFL) (CH) 2023-10-05 — — WO disclosed
WO-2023107574-A2 LIPID-BASED COMPOSITIONS AND METHODS THEREOF THE BRIGHAM AND WOMEN’S HOSPITAL, INC. (US) 2023-06-15 — — WO disclosed
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