SCHEMBL21168337

SCHEMBL21168337

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

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 10/20 0.43
VSIR Q9H7M9 2/20 0.42
CD274 Q9NZQ7 1/20 0.42
NAALAD2 Q9Y3Q0 1/20 0.36
NPY4R P50391 5/20 0.34
NPY1R P25929 3/20 0.34
NPY2R P49146 3/20 0.34
NPY5R Q15761 3/20 0.34
MEN1 O00255 1/20 0.34
ALDH1A1 P00352 1/20 0.34
LMNA P02545 1/20 0.34
KMT2A Q03164 1/20 0.34

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
SCHEMBL21168354 0.96 VSIR (0.41) FOLH1VSIRCD274NPY4RNPY1R
SCHEMBL25477032 0.94 VSIR (0.40) FOLH1VSIRCD274NPY4RNPY1R
SCHEMBL21168315 0.92 FOLH1 (0.41) FOLH1VSIRCD274NAALAD2
SCHEMBL21168345 0.90 VSIR (0.42) FOLH1VSIRCD274NAALAD2
SCHEMBL25477050 0.90 FOLH1 (0.42) FOLH1VSIRCD274NAALAD2
SCHEMBL25477033 0.89 FOLH1 (0.41) FOLH1VSIRCD274
SCHEMBL19967794 0.89 VSIR (0.53) FOLH1VSIRCD274NPY4RNPY1R
SCHEMBL21168316 0.88 FOLH1 (0.47) FOLH1VSIRCD274
SCHEMBL25477041 0.87 VSIR (0.41) FOLH1VSIRCD274NAALAD2
SCHEMBL21168272 0.87 VSIR (0.43) FOLH1VSIRCD274NAALAD2KMT2A

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

“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.