SCHEMBL741130

SCHEMBL741130

CCCCC(CC)COC(=O)ONC(=N)c1ccc2c(c1)C(O[Si](C)(C)C(C)(C)C)CC1(CCN(C(=O)OC(C)(C)C)CC1)O2

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 10/20 0.35
GPR119 Q8TDV5 6/20 0.34
NAMPT P43490 2/20 0.32
PDE4D Q08499 2/20 0.32
PDE4A P27815 1/20 0.31
PDE4B Q07343 1/20 0.31
PDE4C Q08493 1/20 0.31

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
SCHEMBL1813203 0.89 IDO1 (0.34) IDO1GPR119NAMPTPDE4DPDE4A
SCHEMBL309913 0.89 IDO1 (0.34) IDO1GPR119NAMPTPDE4DPDE4A
SCHEMBL309912 0.89 IDO1 (0.34) IDO1GPR119NAMPTPDE4DPDE4A
SCHEMBL743916 0.81 IDO1 (0.44) IDO1GPR119NAMPT
SCHEMBL731339 0.81 IDO1 (0.33) IDO1
SCHEMBL731338 0.81 IDO1 (0.33) IDO1
SCHEMBL15178335 0.77 IDO1 (0.41) IDO1GPR119NAMPT
SCHEMBL309455 0.76 IDO1 (0.41) IDO1GPR119NAMPT
SCHEMBL309454 0.76 IDO1 (0.41) IDO1GPR119NAMPT
SCHEMBL15178373 0.74 IDO1 (0.43) IDO1GPR119NAMPT

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-8138197-B2 Spirochromanon derivatives MSD K.K. (JP) 2012-03-20 US disclosed
US-20090270436-A1 SPIROCHROMANON DERIVATIVES MERCK SHARP & DOHME LLC 2009-10-29 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-20090270436-A1 SPIROCHROMANON DERIVATIVES AKR1C3, CBR3, AKR1C4 IDO1 280/4885GPR119 1243/4885NAMPT 3827/4885

“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.