SCHEMBL21168345

SCHEMBL21168345

N=C(N)NCCC[C@H](NC(=O)N[C@@H](CC(=O)O)C(=O)O)c1nc([C@@H](N)CCC(=O)O)no1

nearest known ligand 0.42

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
VSIR Q9H7M9 2/20 0.42
CD274 Q9NZQ7 1/20 0.42
FOLH1 Q04609 16/20 0.35
RIMKLA Q8IXN7 1/20 0.33
NAALAD2 Q9Y3Q0 1/20 0.33

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
SCHEMBL21168315 0.94 FOLH1 (0.41) VSIRCD274FOLH1RIMKLANAALAD2
SCHEMBL25477041 0.93 VSIR (0.41) VSIRCD274FOLH1NAALAD2
SCHEMBL21168337 0.90 FOLH1 (0.43) VSIRCD274FOLH1NAALAD2
SCHEMBL25477050 0.90 FOLH1 (0.42) VSIRCD274FOLH1RIMKLANAALAD2
SCHEMBL21168316 0.90 FOLH1 (0.47) VSIRCD274FOLH1
SCHEMBL25477033 0.90 FOLH1 (0.41) VSIRCD274FOLH1
SCHEMBL21168272 0.89 VSIR (0.43) VSIRCD274FOLH1RIMKLANAALAD2
SCHEMBL21168369 0.88 VSIR (0.42) VSIRCD274FOLH1
SCHEMBL21168266 0.88 NAALAD2 (0.48) VSIRCD274FOLH1NAALAD2
SCHEMBL21168358 0.87 VSIR (0.43) VSIRCD274FOLH1

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 VSIR 2881/4885CD274 345/4885FOLH1 3099/4885
US-20230144653-A1 1,2,4-Oxadiazole Compounds as Inhibitors of CD47 Signalling Pathways CD47, HIF1AN, PIK3R5 VSIR 2875/4885CD274 215/4885FOLH1 3303/4885
US-20210139536-A1 1,2,4-Oxadiazole Compounds as Inhibitors of CD47 Signalling Pathways CD47, HIF1AN, PIK3R5 VSIR 2875/4885CD274 215/4885FOLH1 3303/4885
US-20190218252-A1 1,2,4-Oxadiazole Compounds as Inhibitors of CD47 Signalling CD47, HIF1AN, PIK3R5 VSIR 2535/4885CD274 106/4885FOLH1 3156/4885

“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.