SCHEMBL21168339

SCHEMBL21168339

COC(=O)C1CCCN1C(=O)NC(CCCNC(=N)N)c1nc([C@@H](N)CCC(=O)O)no1

nearest known ligand 0.33

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ PEPD P12955 3/20 0.33
▸ XPNPEP1 Q9NQW7 2/20 0.33
▸ LMNA P02545 1/20 0.31
▸ RAB9A P51151 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ PKM P14618 1/20 0.31
▸ ACE P12821 3/20 0.31
▸ DPP4 P27487 1/20 0.31
▸ REN P00797 1/20 0.31
▸ P2RY12 Q9H244 2/20 0.31
▸ FKBP1A P62942 2/20 0.30
▸ KMT2A Q03164 1/20 0.30
▸ BMP1 P13497 1/20 0.30

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
SCHEMBL21168341 1.00 PEPD (0.33) PEPDXPNPEP1LMNARAB9ASMN1; SMN2
SCHEMBL21168500 0.96 PEPD (0.33) PEPDXPNPEP1LMNARAB9ASMN1; SMN2
SCHEMBL21168271 0.94 PEPD (0.33) PEPDXPNPEP1LMNARAB9ASMN1; SMN2
SCHEMBL21168277 0.94 PEPD (0.33) PEPDXPNPEP1LMNARAB9ASMN1; SMN2
SCHEMBL25476843 0.92 ACE (0.32) ACEDPP4RENBMP1
SCHEMBL21168320 0.92 ACE (0.36) ACEDPP4RENBMP1
SCHEMBL21168299 0.92 ACE (0.36) ACEDPP4RENBMP1
SCHEMBL31489982 0.92 ACE (0.36) ACEDPP4RENBMP1
SCHEMBL21168270 0.92 PEPD (0.33) PEPDXPNPEP1LMNARAB9ASMN1; SMN2
SCHEMBL31490055 0.92 ACE (0.36) ACEDPP4RENBMP1

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 PEPD 4850/4885XPNPEP1 2956/4885LMNA 2788/4885
US-20230144653-A1 1,2,4-Oxadiazole Compounds as Inhibitors of CD47 Signalling Pathways CD47, HIF1AN, PIK3R5 PEPD 4838/4885XPNPEP1 3023/4885LMNA 3055/4885
US-20210139536-A1 1,2,4-Oxadiazole Compounds as Inhibitors of CD47 Signalling Pathways CD47, HIF1AN, PIK3R5 PEPD 4838/4885XPNPEP1 3023/4885LMNA 3055/4885
US-20190218252-A1 1,2,4-Oxadiazole Compounds as Inhibitors of CD47 Signalling CD47, HIF1AN, PIK3R5 PEPD 4836/4885XPNPEP1 3013/4885LMNA 3138/4885

“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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