SCHEMBL31270368

SCHEMBL31270368

Cc1ccc(OCCC2CC(C)CN(C(=O)OC(C)(C)C)C2)cc1C#N

nearest known ligand 0.42

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 14/20 0.41
PLA2G7 Q13093 1/20 0.40
CHEK2 O96017 1/20 0.37

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
SCHEMBL31270194 0.92 GPR119 (0.44) GPR119PLA2G7CHEK2
SCHEMBL31270202 0.87 GPR119 (0.50) GPR119CHEK2
SCHEMBL31270113 0.85 SLC5A1 (0.43) GPR119CHEK2
SCHEMBL30283471 0.85 GPR119 (0.47) GPR119CHEK2
SCHEMBL29269437 0.85 GPR119 (0.47) GPR119CHEK2
SCHEMBL31270048 0.84 GPR119 (0.41) GPR119CHEK2
SCHEMBL31270052 0.81 GPR119 (0.40) GPR119PLA2G7
SCHEMBL31694949 0.81 PLA2G7 (0.41) GPR119PLA2G7CHEK2
SCHEMBL31269965 0.80 GPR119 (0.46) GPR119CHEK2
SCHEMBL31269860 0.80 RET (0.41) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 GPR119 4139/4885PLA2G7 1499/4885CHEK2 3816/4885

“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.