SCHEMBL25476868

SCHEMBL25476868

CC(=O)C1CCCN1C(=O)N[C@@H](CCCNC(=N)N)c1nc([C@@H](N)CCCCN)no1

nearest known ligand 0.32

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ OPRM1 P35372 9/20 0.32
▸ OPRK1 P41145 9/20 0.32
▸ ITGB3 P05106 3/20 0.31
▸ ITGA2B P08514 3/20 0.31
▸ ACE P12821 1/20 0.31
▸ DPP4 P27487 1/20 0.31
▸ DPP8 Q6V1X1 1/20 0.31
▸ DPP7 Q9UHL4 1/20 0.31
▸ NTMT1 Q9BV86 1/20 0.30
▸ F2 P00734 1/20 0.30

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
SCHEMBL25476870 0.96 F2 (0.32) DPP4F2
SCHEMBL21168338 0.93 ACE (0.36) ACEF2
SCHEMBL21168372 0.93 ACE (0.36) ACEF2
SCHEMBL25476844 0.91 BMP1 (0.33) DPP4F2
SCHEMBL25476845 0.91 VSIR (0.31) DPP4F2
SCHEMBL25476841 0.91 F2 (0.33) ACEDPP4F2
SCHEMBL25476843 0.91 ACE (0.32) ACEDPP4F2
SCHEMBL25476867 0.91 VSIR (0.35) F2
SCHEMBL25476866 0.90 VSIR (0.33) ITGB3ITGA2BF2
SCHEMBL23351265 0.89 FABP4 (0.32) ACEDPP4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230144653-A1 1,2,4-Oxadiazole Compounds as Inhibitors of CD47 Signalling Pathways AURIGENE ONCOLOGY LIMITED (IN) 2023-05-11 — — 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-20230144653-A1 1,2,4-Oxadiazole Compounds as Inhibitors of CD47 Signalling Pathways CD47, HIF1AN, PIK3R5 OPRM1 4595/4885OPRK1 4413/4885ITGB3 241/4885

“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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