SCHEMBL31269860

SCHEMBL31269860

Cc1ccc(OCCC2CN(C(=O)OC(C)(C)C)CCO2)cc1C#N

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
RET P07949 2/20 0.41
EPHA2 P29317 4/20 0.41
GPR119 Q8TDV5 10/20 0.41
P2RX3 P56373 3/20 0.39
P2RX2 Q9UBL9 3/20 0.39
ERBB2 P04626 1/20 0.39
EPHB4 P54760 1/20 0.39

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
SCHEMBL29269445 1.00 RET (0.41) RETEPHA2GPR119P2RX3P2RX2
SCHEMBL31270202 0.85 GPR119 (0.50) GPR119
SCHEMBL31270194 0.84 GPR119 (0.44) GPR119
SCHEMBL31694961 0.84 GPR119 (0.41) EPHA2GPR119ERBB2EPHB4
SCHEMBL29269377 0.84 GPR119 (0.41) EPHA2GPR119ERBB2EPHB4
SCHEMBL29269437 0.83 GPR119 (0.47) GPR119
SCHEMBL30283471 0.83 GPR119 (0.47) GPR119
SCHEMBL31269965 0.80 GPR119 (0.46) GPR119
SCHEMBL31270368 0.80 GPR119 (0.41) GPR119
SCHEMBL31270113 0.79 SLC5A1 (0.43) GPR119

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4301736-B1 MACROCYCLIC COMPOUNDS AS PROTEASOME SUBUNIT BETA TYPE-5 INHIBITORS LEAD DISCOVERY CENTER GMBH (DE) 2025-10-08 EP disclosed
US-20240415819-A1 MACROCYCLIC COMPOUNDS AS PROTEASOME SUBUNIT BETA TYPE-5 INHIBITORS QLi5 Therapeutics AG (DE) 2024-12-19 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-20240415819-A1 MACROCYCLIC COMPOUNDS AS PROTEASOME SUBUNIT BETA TYPE-5 INHIBITORS PSMB5, PSMA5, PSMB1 RET 4687/4885EPHA2 4865/4885GPR119 4139/4885

“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.