SCHEMBL21887032

SCHEMBL21887032

CC(C)(C)OC(=O)N1CC[C@@H](Sc2ccc(C#N)cc2)C1

nearest known ligand 0.56

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 12/20 0.56
MAOA P21397 1/20 0.45
MAOB P27338 1/20 0.45
MEN1 O00255 1/20 0.43
ALDH1A1 P00352 1/20 0.43
MAPT P10636 1/20 0.43
KMT2A Q03164 1/20 0.43
AR P10275 1/20 0.43

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
SCHEMBL24117778 1.00 GPR119 (0.56) GPR119MAOAMAOBMEN1ALDH1A1
SCHEMBL21824803 1.00 GPR119 (0.56) GPR119MAOAMAOBMEN1ALDH1A1
SCHEMBL6881795 0.85 GPR119 (0.50) GPR119ALDH1A1MAPTKMT2A
SCHEMBL6881830 0.85 GPR119 (0.50) GPR119ALDH1A1MAPTKMT2A
SCHEMBL6881798 0.85 GPR119 (0.50) GPR119ALDH1A1MAPTKMT2A
SCHEMBL20002136 0.84 GPR119 (0.49) GPR119MEN1KMT2A
SCHEMBL1881361 0.84 GPR119 (0.49) GPR119ALDH1A1MAPT
SCHEMBL21824778 0.82 MAOA (0.51) GPR119MAOAMAOBALDH1A1KMT2A
SCHEMBL21825012 0.82 MAOA (0.51) GPR119MAOAMAOBALDH1A1KMT2A
SCHEMBL5091205 0.79 GPR119 (0.79) 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 741/4885MAOA 423/4885MAOB 401/4885

“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.