SCHEMBL25476871

SCHEMBL25476871

CC(=O)C1CCCN1C(=O)N[C@@H](CCCNC(=N)N)c1nc([C@@H](N)Cc2ccccc2)no1

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ F2 P00734 5/20 0.39
▸ PLG P00747 1/20 0.38
▸ FKBP1A P62942 3/20 0.37
▸ MME P08473 1/20 0.36
▸ MMEL1 Q495T6 1/20 0.36
▸ ACE P12821 2/20 0.35
▸ OPRM1 P35372 3/20 0.35
▸ OPRK1 P41145 3/20 0.35
▸ PIN1 Q13526 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ HSD17B10 Q99714 1/20 0.35

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
SCHEMBL21168335 0.94 MME (0.40) F2PLGFKBP1AMMEMMEL1
SCHEMBL21168334 0.94 MME (0.40) F2PLGFKBP1AMMEMMEL1
SCHEMBL25476870 0.90 F2 (0.32) F2
SCHEMBL25476866 0.89 VSIR (0.33) F2FKBP1A
SCHEMBL25476843 0.88 ACE (0.32) F2ACE
SCHEMBL25476867 0.88 VSIR (0.35) F2
SCHEMBL21168491 0.87 FKBP1A (0.41) F2FKBP1AACE
SCHEMBL25476845 0.87 VSIR (0.31) F2
SCHEMBL25476873 0.87 DPP4 (0.39) —
SCHEMBL25476868 0.86 OPRM1 (0.32) F2ACEOPRM1OPRK1

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 F2 4693/4885PLG 4364/4885FKBP1A 940/4885

“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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