SCHEMBL21887079

SCHEMBL21887079

CC(C)(C)OC(=O)N1CC[C@H](Oc2ccc(C#N)cn2)C1

nearest known ligand 0.58

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 10/20 0.58
PIK3CD O00329 9/20 0.51
PIK3CA P42336 3/20 0.47
PIK3CB P42338 2/20 0.47
PIK3CG P48736 2/20 0.47

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
SCHEMBL21886886 1.00 GPR119 (0.58) GPR119PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL21886888 1.00 GPR119 (0.58) GPR119PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL2776233 0.94 GPR119 (0.66) GPR119
SCHEMBL14302003 0.91 GPR119 (0.52) GPR119PIK3CD
SCHEMBL21887083 0.84 GPR119 (0.59) GPR119PIK3CDPIK3CA
SCHEMBL20234855 0.84 GPR119 (0.59) GPR119PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL26774174 0.84 GPR119 (0.59) GPR119PIK3CDPIK3CA
SCHEMBL26774179 0.84 GPR119 (0.59) GPR119PIK3CDPIK3CA
SCHEMBL21824940 0.84 DPP4 (0.48) GPR119
SCHEMBL21825062 0.84 DPP4 (0.48) 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
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 2634/4885PIK3CA 2320/4885

“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.