SCHEMBL25539657

SCHEMBL25539657

CC(C)(C)OC(=O)N1CCOC(COc2ccc(N)c(F)c2)C1

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ EPHA2 P29317 4/20 0.46
▸ PDK1 Q15118 2/20 0.45
▸ GPR119 Q8TDV5 2/20 0.45
▸ ERBB2 P04626 1/20 0.45
▸ EPHB4 P54760 1/20 0.45
▸ P2RX3 P56373 3/20 0.44
▸ P2RX2 Q9UBL9 3/20 0.44
▸ BUB1 O43683 1/20 0.44
▸ CSF1R P07333 1/20 0.41
▸ RET P07949 2/20 0.41
▸ NR1H4 Q96RI1 1/20 0.41

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
SCHEMBL20521629 0.85 EPHA2 (0.43) EPHA2PDK1GPR119ERBB2EPHB4
SCHEMBL24933225 0.82 EPHA2 (0.58) EPHA2PDK1GPR119ERBB2EPHB4
SCHEMBL1852171 0.81 PDK1 (0.51) EPHA2PDK1GPR119ERBB2EPHB4
SCHEMBL13984286 0.81 PDK1 (0.48) EPHA2PDK1ERBB2EPHB4P2RX3
SCHEMBL1848811 0.81 EPHA2 (0.50) EPHA2PDK1ERBB2EPHB4P2RX3
SCHEMBL13984639 0.81 EPHA2 (0.50) EPHA2PDK1ERBB2EPHB4P2RX3
SCHEMBL306369 0.80 EPHA2 (0.50) EPHA2PDK1GPR119ERBB2EPHB4
SCHEMBL9210866 0.80 KDM4E (0.49) EPHA2PDK1ERBB2EPHB4
SCHEMBL12661155 0.80 PDK1 (0.49) EPHA2PDK1GPR119ERBB2EPHB4
SCHEMBL20521472 0.80 NPSR1 (0.43) EPHA2PDK1GPR119BUB1NR1H4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230159564-A1 2-Oxo-Thiazole Derivatives as A2A Inhibitors and Compounds for Use in the Treatment of Cancers iTeos Belgium SA (BE) 2023-05-25 — — 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 (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-20230159564-A1 2-Oxo-Thiazole Derivatives as A2A Inhibitors and Compounds for Use in the Treatment of Cancers ADORA2A, ADORA2B, ADORA3 EPHA2 108/4885PDK1 241/4885GPR119 407/4885

“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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