SCHEMBL19969263

SCHEMBL19969263

CC(O)[C@H](N)c1noc([C@H](CCC(N)=O)NC(=O)NCC(=O)O)n1

nearest known ligand 0.47

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
VSIR Q9H7M9 2/20 0.47
CD274 Q9NZQ7 1/20 0.47
SRC P12931 5/20 0.37
ZAP70 P43403 7/20 0.36
LMNA P02545 1/20 0.30
TSHR P16473 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
SCHEMBL19969055 1.00 VSIR (0.47) VSIRCD274SRCZAP70LMNA
SCHEMBL24086186 1.00 VSIR (0.47) VSIRCD274SRCZAP70LMNA
SCHEMBL19969098 1.00 VSIR (0.47) VSIRCD274SRCZAP70LMNA
SCHEMBL21377529 0.89 VSIR (0.44) VSIRCD274LMNATSHR
SCHEMBL18735673 0.85 CD274 (0.65) VSIRCD274SRCZAP70LMNA
SCHEMBL20626602 0.85 CD274 (0.65) VSIRCD274SRCZAP70LMNA
SCHEMBL20057309 0.85 CD274 (0.65) VSIRCD274SRCZAP70LMNA
SCHEMBL16557045 0.85 CD274 (0.65) VSIRCD274SRCZAP70LMNA
SCHEMBL21738408 0.83 VSIR (0.50) VSIRCD274SRCZAP70
SCHEMBL16557043 0.83 CD274 (0.55) VSIRCD274SRCZAP70LMNA

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210379024-A1 METHOD OF MODULATING TIGIT AND PD-1 SIGNALLING PATHWAYS USING 1,2,4-OXADIAZOLE COMPOUNDS AURIGENE ONCOLOGY LIMITED (IN) 2021-12-09 US disclosed
WO-2019175799-A2 METHOD OF MODULATING TIGIT AND PD-1 SIGNALLING PATHWAYS USING 1,2,4-OXADIAZOLE COMPOUNDS AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) 2019-09-19 WO disclosed
WO-2018047139-A1 COMPOUNDS AS MODULATORS OF TIGIT SIGNALLING PATHWAY AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) 2018-03-15 WO 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 (1 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-20210379024-A1 METHOD OF MODULATING TIGIT AND PD-1 SIGNALLING PATHWAYS USING 1,2,4-OXADIAZOLE COMPOUNDS PDCD1, CD274, PDCD1LG2 VSIR 1596/4885CD274 2/4885SRC 460/4885

“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.