SCHEMBL2881359

SCHEMBL2881359

CC(C)(C)[Si](C)(C)OCCc1ccc(CO)cc1F

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 1/20 0.35
CYP4A11 Q02928 1/20 0.35
S1PR1 P21453 1/20 0.33
TLR7 Q9NYK1 1/20 0.32
RXRG P48443 1/20 0.32
PPARG P37231 1/20 0.31
PPARA Q07869 1/20 0.31
DUT P33316 2/20 0.31
KIF11 P52732 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
SCHEMBL13849579 0.86 CYP4F2 (0.37) CYP4F2CYP4A11S1PR1TLR7RXRG
SCHEMBL1246200 0.81 CYP4F2 (0.33) CYP4F2CYP4A11DUT
SCHEMBL2881111 0.80 APLNR (0.41)
SCHEMBL2879524 0.80 ALDH1A1 (0.48) TLR7
SCHEMBL1895137 0.77 ESRRG (0.37)
SCHEMBL24570669 0.77 CYP4F2 (0.47) CYP4F2CYP4A11S1PR1DUT
SCHEMBL29746288 0.77 CYP4F2 (0.47) CYP4F2CYP4A11S1PR1DUT
SCHEMBL1245422 0.76 TAAR1 (0.44) DUT
SCHEMBL20160917 0.74 GPR84 (0.35) DUT
SCHEMBL29682062 0.74 DUT (0.32) TLR7DUT

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-20100216758-A1 Pyridone Compounds MSD K.K. (JP) 2010-08-26 US disclosed
EP-1916239-A1 PYRIDONE COMPOUND BANYU PHARMACEUTICAL CO., LTD. (JP) 2008-04-30 EP 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-20100216758-A1 Pyridone Compounds NPY1R, MC5R, MC1R CYP4F2 381/4885CYP4A11 409/4885S1PR1 724/4885

“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.