SCHEMBL25476869

SCHEMBL25476869

CC(=O)C1CCCN1C(=O)N[C@@H](CCCNC(=N)N)c1nc([C@@H](N)Cc2cnc[nH]2)no1

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ PLK1 P53350 1/20 0.39
▸ TRHR P34981 1/20 0.37
▸ DPP4 P27487 1/20 0.36
▸ REN P00797 2/20 0.36
▸ ACE2 Q9BYF1 2/20 0.35
▸ CXCR4 P61073 4/20 0.35
▸ RAMP3 O60896 7/20 0.34
▸ CALCR P30988 7/20 0.34
▸ DPP7 Q9UHL4 1/20 0.34
▸ APLNR P35414 1/20 0.32

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
SCHEMBL21168365 0.94 PLK1 (0.38) PLK1TRHRDPP4RENACE2
SCHEMBL21168366 0.94 PLK1 (0.38) PLK1TRHRDPP4RENACE2
SCHEMBL25476870 0.88 F2 (0.32) DPP4
SCHEMBL25476871 0.86 F2 (0.39) —
SCHEMBL25476867 0.85 VSIR (0.35) —
SCHEMBL25476845 0.85 VSIR (0.31) DPP4
SCHEMBL25476866 0.85 VSIR (0.33) —
SCHEMBL25476843 0.84 ACE (0.32) DPP4REN
SCHEMBL25476868 0.84 OPRM1 (0.32) DPP4DPP7
SCHEMBL25476859 0.83 REN (0.47) TRHRDPP4RENACE2DPP7

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 PLK1 2147/4885TRHR 2999/4885DPP4 4748/4885

“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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