SCHEMBL21168325

SCHEMBL21168325

N[C@@H](CCC(=O)O)c1noc([C@H](Cc2ccccc2)NC(=O)N2CCC[C@H]2C(=O)O)n1

nearest known ligand 0.46

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ ACE P12821 12/20 0.46
▸ LTA4H P09960 5/20 0.46
▸ MME P08473 1/20 0.43
▸ MMEL1 Q495T6 1/20 0.43
▸ ACE2 Q9BYF1 2/20 0.43

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
SCHEMBL21168326 1.00 ACE (0.46) ACELTA4HMMEMMEL1ACE2
SCHEMBL21168319 0.94 ACE (0.45) ACELTA4HMMEMMEL1ACE2
SCHEMBL21168285 0.94 ACE (0.45) ACELTA4HMMEMMEL1ACE2
SCHEMBL25476877 0.93 ACE (0.41) ACELTA4HMMEMMEL1ACE2
SCHEMBL21999680 0.92 ACE (0.44) ACELTA4HMMEMMEL1ACE2
SCHEMBL19969548 0.91 ACE (0.46) ACELTA4HMMEMMEL1ACE2
SCHEMBL19969264 0.91 ACE (0.46) ACELTA4HMMEMMEL1ACE2
SCHEMBL21168349 0.89 ACE (0.43) ACELTA4HMMEMMEL1
SCHEMBL21168368 0.89 ACE (0.43) ACELTA4HMMEMMEL1
SCHEMBL25476861 0.88 ACE (0.40) ACELTA4HMMEMMEL1

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 ACE 4818/4885LTA4H 4359/4885MME 4839/4885
US-20230144653-A1 1,2,4-Oxadiazole Compounds as Inhibitors of CD47 Signalling Pathways CD47, HIF1AN, PIK3R5 ACE 4811/4885LTA4H 4332/4885MME 4851/4885
US-20210139536-A1 1,2,4-Oxadiazole Compounds as Inhibitors of CD47 Signalling Pathways CD47, HIF1AN, PIK3R5 ACE 4811/4885LTA4H 4332/4885MME 4851/4885
US-20190218252-A1 1,2,4-Oxadiazole Compounds as Inhibitors of CD47 Signalling CD47, HIF1AN, PIK3R5 ACE 4810/4885LTA4H 4277/4885MME 4850/4885

“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.

Send feedback