SCHEMBL31270222

SCHEMBL31270222

Cc1ccc(OC2CCN(C(=O)OC(C)(C)C)C2)cc1CN

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 4/20 0.48
USP30 Q70CQ3 1/20 0.47
CHEK2 O96017 2/20 0.45
PIK3CD O00329 5/20 0.44
HRH3 Q9Y5N1 1/20 0.43
PIK3CA P42336 2/20 0.42
PIK3CB P42338 2/20 0.42
PIK3CG P48736 2/20 0.42
PDE4B Q07343 1/20 0.42
S1PR3 Q99500 1/20 0.42

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
SCHEMBL31270127 0.94 CHEK2 (0.51) GPR119USP30CHEK2PIK3CDHRH3
SCHEMBL31269796 0.94 GPR119 (0.54) GPR119CHEK2HRH3PDE4B
SCHEMBL24117863 0.86 GPR119 (0.56) GPR119USP30CHEK2PIK3CDHRH3
SCHEMBL3342818 0.85 GPR119 (0.54) GPR119CHEK2HRH3PDE4B
SCHEMBL15202720 0.84 GPR119 (0.48) GPR119USP30CHEK2PIK3CDHRH3
SCHEMBL31270177 0.83 CHEK2 (0.47) GPR119CHEK2
SCHEMBL5089073 0.83 GPR119 (0.54) GPR119USP30CHEK2PIK3CDS1PR3
SCHEMBL31269794 0.82 GPR119 (0.51) GPR119CHEK2
SCHEMBL29276820 0.81 GPR119 (0.52) GPR119USP30CHEK2PIK3CDHRH3
SCHEMBL29276822 0.81 GPR119 (0.52) GPR119USP30CHEK2PIK3CDHRH3

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 4139/4885USP30 81/4885CHEK2 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.