SCHEMBL21168335

SCHEMBL21168335

N=C(N)NCCC[C@H](NC(=O)N1CCCC1C(=O)O)c1nc([C@@H](N)Cc2ccccc2)no1

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ MME P08473 1/20 0.40
▸ MMEL1 Q495T6 1/20 0.40
▸ ACE P12821 9/20 0.40
▸ LTA4H P09960 5/20 0.40
▸ F2 P00734 1/20 0.39
▸ PLG P00747 1/20 0.39
▸ ACE2 Q9BYF1 2/20 0.38
▸ FKBP1A P62942 2/20 0.38

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
SCHEMBL21168334 1.00 MME (0.40) MMEMMEL1ACELTA4HF2
SCHEMBL25476871 0.94 F2 (0.39) MMEMMEL1ACEF2PLG
SCHEMBL21168491 0.93 FKBP1A (0.41) ACEF2FKBP1A
SCHEMBL21168289 0.91 FABP4 (0.32) MMEMMEL1FKBP1A
SCHEMBL21168290 0.91 FABP4 (0.32) MMEMMEL1FKBP1A
SCHEMBL23351265 0.89 FABP4 (0.32) MMEMMEL1ACEFKBP1A
SCHEMBL21168342 0.88 VSIR (0.35) MMEMMEL1ACELTA4HFKBP1A
SCHEMBL21168352 0.88 VSIR (0.35) MMEMMEL1ACELTA4HFKBP1A
SCHEMBL21168362 0.88 ACE (0.33) MMEMMEL1ACEFKBP1A
SCHEMBL21168340 0.88 ACE (0.33) MMEMMEL1ACEFKBP1A

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 5 patents. 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
US-20230144653-A1 1,2,4-Oxadiazole Compounds as Inhibitors of CD47 Signalling Pathways AURIGENE ONCOLOGY LIMITED (IN) 2023-05-11 — — US disclosed
US-11560403-B2 1,2,4-oxadiazole compounds as inhibitors of CD47 signaling pathways AURIGENE ONCOLOGY LIMITED (IN) 2023-01-24 — — US disclosed
US-20210139536-A1 1,2,4-Oxadiazole Compounds as Inhibitors of CD47 Signalling Pathways AURIGENE ONCOLOGY LIMITED (IN) 2021-05-13 — — US disclosed
US-20190218252-A1 1,2,4-Oxadiazole Compounds as Inhibitors of CD47 Signalling AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) 2019-07-18 — — 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 (4 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-11560403-B2 1,2,4-oxadiazole compounds as inhibitors of CD47 signaling pathways CD47, HIF1AN, PIK3R5 MME 4839/4885MMEL1 2202/4885ACE 4818/4885
US-20230144653-A1 1,2,4-Oxadiazole Compounds as Inhibitors of CD47 Signalling Pathways CD47, HIF1AN, PIK3R5 MME 4851/4885MMEL1 2379/4885ACE 4811/4885
US-20210139536-A1 1,2,4-Oxadiazole Compounds as Inhibitors of CD47 Signalling Pathways CD47, HIF1AN, PIK3R5 MME 4851/4885MMEL1 2379/4885ACE 4811/4885
US-20190218252-A1 1,2,4-Oxadiazole Compounds as Inhibitors of CD47 Signalling CD47, HIF1AN, PIK3R5 MME 4850/4885MMEL1 2263/4885ACE 4810/4885

“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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