SCHEMBL31270241

SCHEMBL31270241

Cc1cc(OCCC2CCCN(C(=O)OC(C)(C)C)C2)cc(CN)c1C

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 8/20 0.43
CYP2C9 P11712 1/20 0.43
BACE1 P56817 2/20 0.43
CTSD P07339 1/20 0.43
CHEK2 O96017 2/20 0.41
SCN9A Q15858 1/20 0.41
KAT7 O95251 2/20 0.40
KAT8 Q9H7Z6 1/20 0.40
FPR3 P25089 1/20 0.40
FPR2 P25090 1/20 0.40
ALOX5AP P20292 1/20 0.40
FEN1 P39748 1/20 0.40
ACKR3 P25106 1/20 0.39
KAT6A Q92794 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
SCHEMBL29269441 0.89 GPR119 (0.47) GPR119CYP2C9BACE1CTSDCHEK2
SCHEMBL29269366 0.84 GPR119 (0.53) GPR119CYP2C9BACE1CTSDCHEK2
SCHEMBL31270116 0.84 MEN1 (0.46) GPR119CYP2C9BACE1CTSDCHEK2
SCHEMBL31270183 0.84 SCN9A (0.43) CYP2C9BACE1CTSDCHEK2SCN9A
SCHEMBL29269340 0.84 SCN9A (0.43) CYP2C9BACE1CTSDCHEK2SCN9A
SCHEMBL31270437 0.83 GPR119 (0.46) GPR119CYP2C9BACE1CTSDCHEK2
SCHEMBL31269794 0.83 GPR119 (0.51) GPR119CHEK2SCN9A
SCHEMBL29269431 0.81 ALDH1A1 (0.39)
SCHEMBL31270293 0.80 HTR6 (0.47) GPR119CYP2C9BACE1CTSDCHEK2
SCHEMBL31270108 0.79 CHEK2 (0.53) GPR119CYP2C9BACE1CTSDCHEK2

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 GPR119 4139/4885CYP2C9 2797/4885BACE1 208/4885

“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.