SCHEMBL21168357

SCHEMBL21168357

N[C@@H](CCC(=O)O)c1noc([C@H](Cc2c[nH]c3ccccc23)NC(=O)N2CCC[C@H]2C(=O)O)n1

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CYP2C19 P33261 1/20 0.43
▸ DPP4 P27487 2/20 0.43
▸ DPP3 Q9NY33 1/20 0.40
▸ MAPK1 P28482 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ SRC P12931 1/20 0.39
▸ TACR1 P25103 1/20 0.39
▸ BCHE P06276 1/20 0.39
▸ GHSR Q92847 1/20 0.39
▸ SMYD3 Q9H7B4 1/20 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
SCHEMBL21168348 1.00 CYP2C19 (0.43) CYP2C19DPP4DPP3MAPK1L3MBTL1
SCHEMBL21168350 1.00 CYP2C19 (0.43) CYP2C19DPP4DPP3MAPK1L3MBTL1
SCHEMBL25476880 0.94 DPP4 (0.42) DPP4DPP3MAPK1L3MBTL1SRC
SCHEMBL25476997 0.94 DPP4 (0.42) DPP4DPP3MAPK1L3MBTL1SRC
SCHEMBL21168325 0.86 ACE (0.46) —
SCHEMBL21168326 0.86 ACE (0.46) —
SCHEMBL21168313 0.84 CYP2C19 (0.40) CYP2C19DPP4DPP3TACR1BCHE
SCHEMBL21168312 0.84 CYP2C19 (0.40) CYP2C19DPP4DPP3TACR1BCHE
SCHEMBL21168349 0.83 ACE (0.43) DPP4
SCHEMBL21168368 0.83 ACE (0.43) DPP4

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 4 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-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 CYP2C19 4793/4885DPP4 4769/4885DPP3 4662/4885
US-20230144653-A1 1,2,4-Oxadiazole Compounds as Inhibitors of CD47 Signalling Pathways CD47, HIF1AN, PIK3R5 CYP2C19 4760/4885DPP4 4748/4885DPP3 4624/4885
US-20210139536-A1 1,2,4-Oxadiazole Compounds as Inhibitors of CD47 Signalling Pathways CD47, HIF1AN, PIK3R5 CYP2C19 4760/4885DPP4 4748/4885DPP3 4624/4885
US-20190218252-A1 1,2,4-Oxadiazole Compounds as Inhibitors of CD47 Signalling CD47, HIF1AN, PIK3R5 CYP2C19 4764/4885DPP4 4730/4885DPP3 4599/4885

“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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