SCHEMBL29779192

SCHEMBL29779192

CC[C@H](C)[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)CO)C(=O)N[C@@H](CCC(N)=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)O

nearest known ligand 0.64

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ AGTR2 P50052 3/20 0.64
▸ AGTR1 P30556 1/20 0.64
▸ GNRHR P30968 2/20 0.60
▸ ABCC2 Q92887 1/20 0.60
▸ CXCR4 P61073 4/20 0.59
▸ PTGS1 P23219 1/20 0.58
▸ NPY1R P25929 1/20 0.58
▸ NPY2R P49146 1/20 0.58
▸ NPY4R P50391 1/20 0.58
▸ NPY5R Q15761 1/20 0.58
▸ REN P00797 3/20 0.55
▸ NTSR2 O95665 1/20 0.55
▸ NTSR1 P30989 1/20 0.55
▸ PTH1R Q03431 1/20 0.54
▸ F2 P00734 1/20 0.54
▸ APLNR P35414 1/20 0.53

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
SCHEMBL29497292 0.87 AGTR2 (0.67) AGTR2AGTR1GNRHRABCC2CXCR4
SCHEMBL29350127 0.87 NTSR2 (0.63) AGTR2AGTR1GNRHRABCC2CXCR4
SCHEMBL29627461 0.80 TACR1 (0.60) AGTR2AGTR1CXCR4NTSR2NTSR1
SCHEMBL30433133 0.80 NPY1R (0.64) CXCR4NPY1RNPY2RNPY4RNPY5R
SCHEMBL29602731 0.80 C5AR1 (0.63) AGTR2AGTR1NTSR2NTSR1
SCHEMBL28485749 0.79 AGTR2 (0.94) AGTR2AGTR1NTSR2NTSR1
SCHEMBL29445593 0.79 KISS1R (0.61) CXCR4NPY1RNPY2RNPY4RNPY5R
SCHEMBL31073544 0.79 KISS1R (0.57) NPY1RNPY2RNPY4RNPY5RREN
SCHEMBL29619824 0.79 AGTR2 (0.94) AGTR2AGTR1
SCHEMBL7402113 0.79 MAGI3 (0.56) AGTR2AGTR1CXCR4NPY1RNPY2R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4662319-A2 PERSONALIZED CRISPR PROFILING FOR CANCER Integrate Bioscience LLC (US) 2025-12-17 — — EP disclosed
EP-4622962-A1 SMALL MOLECULAR WEIGHT CHEMICAL COMPOUND TO ANTAGONIZE EPH-EPHRIN TETRAMERIZATION AND INHIBIT BIDIRECTIONAL SIGNALING The Board of Regents of the University of Texas System (US) 2025-10-01 — — EP disclosed
EP-4511052-A2 EPHRIN LIGAND MIMETIC PEPTIDES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES University of Miami (US) 2025-02-26 — — EP disclosed
US-20250042968-A1 EPHRIN LIGAND MIMETIC PEPTIDES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES UNIV MIAMI (US) 2025-02-06 — — US disclosed
WO-2024168301-A2 PERSONALIZED CRISPR PROFILING FOR CANCER FUNCTION ONCOLOGY, INC. (US) 2024-08-15 — — WO disclosed
WO-2024092083-A1 SMALL MOLECULAR WEIGHT CHEMICAL COMPOUND TO ANTAGONIZE EPH-EPHRIN TETRAMERIZATION AND INHIBIT BIDIRECTIONAL SIGNALING THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2024-05-02 — — WO disclosed
WO-2023205752-A2 EPHRIN LIGAND MIMETIC PEPTIDES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES UNIVERSITY OF MIAMI (US) 2023-10-26 — — WO disclosed
US-20220251143-A1 NON-HYDROLYZABLE NON-CLEAVABLE, STABLE LINKERS FOR PRECISION THERAPEUTICS AND USES THEREOF UNIV COLUMBIA (US) 2022-08-11 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20220251143-A1 NON-HYDROLYZABLE NON-CLEAVABLE, STABLE LINKERS FOR PRECISION THERAPEUTICS AND USES THEREOF SSTR4, SSTR1, SSTR5 AGTR2 731/4885AGTR1 700/4885GNRHR 12/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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