SCHEMBL924134

SCHEMBL924134

COc1ccc2nccc(C=C[C@@H]3CCN(C(=O)OC(C)(C)C)C3)c2n1

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 9/20 0.44
PIK3CD O00329 5/20 0.42
USP30 Q70CQ3 2/20 0.40
CYP8B1 Q9UNU6 1/20 0.39
PIK3CA P42336 4/20 0.39
PIK3CB P42338 3/20 0.39
PIK3CG P48736 3/20 0.39
MAP4K4 O95819 1/20 0.38

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
SCHEMBL924135 1.00 GPR119 (0.44) GPR119PIK3CDUSP30CYP8B1PIK3CA
SCHEMBL924133 1.00 GPR119 (0.44) GPR119PIK3CDUSP30CYP8B1PIK3CA
SCHEMBL2537062 0.79 JAK1 (0.40) MAP4K4
SCHEMBL2537065 0.79 JAK1 (0.40) MAP4K4
SCHEMBL3374285 0.79 JAK1 (0.40) MAP4K4
SCHEMBL2537063 0.79 JAK1 (0.40) MAP4K4
SCHEMBL3374280 0.79 JAK1 (0.40) MAP4K4
SCHEMBL634126 0.77 KCNH2 (0.44) GPR119PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL634125 0.77 KCNH2 (0.44) GPR119PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL2252681 0.77 KCNH2 (0.35)

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-9505750-B2 5-aminocyclylmethyl-oxazolidin-2-one derivatives ACTELION PHARMACEUTICALS LTD. (CH) 2016-11-29 US disclosed
US-20110003789-A1 5-AMINOCYCLYLMETHYL-OXAZOLIDIN-2-ONE DERIVATIVES IDORSIA PHARMACEUTICALS LTD (CH) 2011-01-06 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-20110003789-A1 5-AMINOCYCLYLMETHYL-OXAZOLIDIN-2-ONE DERIVATIVES CNKSR1, KCNH1, CBR3 GPR119 2186/4885PIK3CD 3587/4885USP30 3264/4885

“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.