SCHEMBL21886880

SCHEMBL21886880

CC(C)(C)OC(=O)N1CC[C@H](Oc2ccc(C#N)nc2)C1

nearest known ligand 0.59

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 8/20 0.59
PIK3CD O00329 6/20 0.49
USP30 Q70CQ3 1/20 0.48
PIK3CA P42336 2/20 0.45
PIK3CB P42338 2/20 0.45
PIK3CG P48736 2/20 0.45

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
SCHEMBL23311686 0.93 GPR119 (0.67) GPR119
SCHEMBL24111531 0.91 GPR119 (0.53) GPR119USP30
SCHEMBL31398187 0.91 GPR119 (0.53) GPR119USP30
SCHEMBL22031763 0.90 GPR119 (0.51) GPR119PIK3CDUSP30PIK3CAPIK3CB
SCHEMBL28415375 0.90 GPR119 (0.51) GPR119PIK3CDUSP30PIK3CAPIK3CB
SCHEMBL28423794 0.90 GPR119 (0.51) GPR119PIK3CDUSP30PIK3CAPIK3CB
SCHEMBL31044625 0.88 GPR119 (0.48) GPR119PIK3CDUSP30PIK3CAPIK3CB
SCHEMBL28419935 0.88 GPR119 (0.48) GPR119PIK3CDUSP30PIK3CAPIK3CB
SCHEMBL31044622 0.88 GPR119 (0.48) GPR119PIK3CDUSP30PIK3CAPIK3CB
SCHEMBL28412010 0.88 GPR119 (0.48) GPR119PIK3CDUSP30PIK3CAPIK3CB

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
US-20210392895-A1 NOVEL OXADIAZOLES PI INDUSTRIES LIMITED (IN) 2021-12-23 US disclosed
WO-2020070610-A1 NOVEL OXADIAZOLES PI INDUSTRIES LTD. (IN) 2020-04-09 WO 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-20210392895-A1 NOVEL OXADIAZOLES OXA1L, CYP1B1, CYP1A1 GPR119 741/4885PIK3CD 2634/4885USP30 4128/4885

“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.