SCHEMBL30839656

SCHEMBL30839656

O=C1N[C@@H](Cc2c[nH]cn2)C(=O)N[C@H]1Cc1ccc(O)cc1

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CAPN1 P07384 1/20 0.39
GAA P10253 2/20 0.39
CXCR4 P61073 6/20 0.38
ITGB1 P05556 2/20 0.37
ITGA4 P13612 2/20 0.37
MLNR O43193 2/20 0.36
ANPEP P15144 1/20 0.36
LNPEP Q9UIQ6 1/20 0.36
HRH3 Q9Y5N1 2/20 0.36

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
SCHEMBL9666911 1.00 CAPN1 (0.39) CAPN1GAACXCR4ITGB1ITGA4
SCHEMBL9666919 1.00 CAPN1 (0.39) CAPN1GAACXCR4ITGB1ITGA4
SCHEMBL9479076 0.85 HRH3 (0.45) GAAHRH3
SCHEMBL8102895 0.85 HRH3 (0.45) GAAHRH3
SCHEMBL6753882 0.85 HRH3 (0.45) GAAHRH3
SCHEMBL9666858 0.85 HRH3 (0.45) GAAHRH3
SCHEMBL9665668 0.85 HRH3 (0.45) GAAHRH3
SCHEMBL8102889 0.85 HRH3 (0.45) GAAHRH3
SCHEMBL9478999 0.84
SCHEMBL9666883 0.84

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240140955-A1 PEG-MODIFIED CYCLIC DIPEPTIDES NOVMETAPHARMA CO., LTD. (KR) 2024-05-02 US claimed
EP-4594325-A1 PEG-MODIFIED CYCLIC DIPEPTIDES Novmetapharma Co., Ltd. (KR) 2025-08-06 EP disclosed
US-20240140955-A1 PEG-MODIFIED CYCLIC DIPEPTIDES NOVMETAPHARMA CO., LTD. (KR) 2024-05-02 US disclosed
WO-2024069524-A1 PEG-MODIFIED CYCLIC DIPEPTIDES NOVMETAPHARMA CO., LTD. (KR) 2024-04-04 WO 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-20240140955-A1 PEG-MODIFIED CYCLIC DIPEPTIDES LNPEP, ANPEP, DNPEP CAPN1 1195/4885GAA 1465/4885CXCR4 500/4885

“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.