SCHEMBL21887547

SCHEMBL21887547

CC(C)(C)OC(=O)N1CCC(Oc2cccc(C#N)c2)C1

nearest known ligand 0.61

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 6/20 0.61
USP30 Q70CQ3 1/20 0.53
MGLL Q99685 8/20 0.50
ALK Q9UM73 1/20 0.50
CYP11B1 P15538 1/20 0.49
CYP11B2 P19099 1/20 0.49
EPHX2 P34913 1/20 0.49
SLC6A2 P23975 1/20 0.46
SLC6A4 P31645 1/20 0.46
SLC6A3 Q01959 1/20 0.46

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
SCHEMBL21825159 1.00 GPR119 (0.61) GPR119USP30MGLLALKCYP11B1
SCHEMBL3605978 0.93 GPR119 (0.69) GPR119MGLLALKEPHX2
SCHEMBL30324507 0.91 GPR119 (0.54) GPR119USP30MGLLALKEPHX2
SCHEMBL14861962 0.91 GPR119 (0.54) GPR119USP30MGLLALKEPHX2
SCHEMBL19023577 0.87 GPR119 (0.51) GPR119USP30MGLLALKEPHX2
SCHEMBL19023579 0.87 GPR119 (0.51) GPR119USP30MGLLALKEPHX2
SCHEMBL15050771 0.87 GPR119 (0.64) GPR119MGLLALKCYP11B1CYP11B2
SCHEMBL19023578 0.87 GPR119 (0.51) GPR119USP30MGLLALKEPHX2
SCHEMBL24117836 0.86 GPR119 (0.79) GPR119USP30ALK
SCHEMBL5091205 0.86 GPR119 (0.79) GPR119USP30ALK

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 3 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
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 741/4885USP30 4128/4885MGLL 4457/4885

“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.