SCHEMBL279337

SCHEMBL279337

C=C(/N=C/c1cc(I)ccc1OC1CCN(C(=O)OC(C)(C)C)CC1)O[Si](C)(C)C

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 3/20 0.44
PDE4D Q08499 3/20 0.44
PDE4A P27815 2/20 0.44
PDE4C Q08493 2/20 0.44
GPR119 Q8TDV5 10/20 0.43
TOP2A P11388 1/20 0.40
KDM1A O60341 1/20 0.40
NPBWR1 P48145 1/20 0.39
MCHR1 Q99705 1/20 0.39
CHEK2 O96017 1/20 0.38
PIK3CD O00329 2/20 0.38
PIK3CA P42336 2/20 0.38
PIK3CB P42338 2/20 0.38
PIK3CG P48736 2/20 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
SCHEMBL279312 0.95 PIK3CD (0.44) PDE4BPDE4DPDE4APDE4CGPR119
SCHEMBL279056 0.89 PDE4B (0.44) PDE4BPDE4DPDE4APDE4CGPR119
SCHEMBL279333 0.88 GPR119 (0.40) GPR119CHEK2
SCHEMBL279069 0.88 GPR119 (0.44) PDE4BPDE4DPDE4APDE4CGPR119
SCHEMBL279410 0.85 PDE4B (0.38) PDE4BPDE4DPDE4APDE4CGPR119
SCHEMBL275711 0.85 PDE4B (0.38) PDE4BPDE4DPDE4APDE4CGPR119
SCHEMBL278898 0.84 PIK3CD (0.44) PDE4BPDE4DPDE4APDE4CGPR119
SCHEMBL275205 0.82 PDE4B (0.52) PDE4BPDE4DPDE4APDE4CGPR119
SCHEMBL276159 0.81 PDE4D (0.35) PDE4BPDE4DPDE4APDE4C
SCHEMBL279509 0.81 PDE4D (0.35) PDE4BPDE4DPDE4APDE4C

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-8134001-B2 Spiroindolinone derivatives HOFFMANN-LA ROCHE INC. (US) 2012-03-13 US disclosed
US-20090156610-A1 Spiroindolinone Derivatives DING QINGJIE 2009-06-18 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-20090156610-A1 Spiroindolinone Derivatives SDHA, AR, XPOT PDE4B 3594/4885PDE4D 2759/4885PDE4A 3090/4885

“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.