SCHEMBL5423992

SCHEMBL5423992

CC(C)(C)[Si](C)(C)OCCCCc1cccc(S(C)(=O)=O)c1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 2/20 0.38
GRM3 Q14832 2/20 0.38
TMEM97 Q5BJF2 2/20 0.38
CYP4F2 P78329 1/20 0.37
CYP4A11 Q02928 1/20 0.37
DUT P33316 1/20 0.36
GLS O94925 1/20 0.36
LOXL2 Q9Y4K0 3/20 0.36
LOX P28300 1/20 0.35
ALDH1A1 P00352 1/20 0.34
GAA P10253 1/20 0.34
HSD17B10 Q99714 1/20 0.34
HTR6 P50406 1/20 0.34

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
SCHEMBL5697287 0.80 LPL (0.38) GRM2GRM3CYP4F2CYP4A11GLS
SCHEMBL30765766 0.80 DUT (0.40) DUT
SCHEMBL1247083 0.79 CYP4F2 (0.37) CYP4F2CYP4A11DUT
SCHEMBL5280684 0.79 MAOB (0.44) DUTGLS
SCHEMBL1627498 0.79 CYP4F2 (0.40) CYP4F2CYP4A11DUT
SCHEMBL1246141 0.78 DUT (0.37) CYP4F2CYP4A11DUT
SCHEMBL17398452 0.77 IDO1 (0.47) DUT
SCHEMBL16307320 0.76 IDO1 (0.46)
SCHEMBL17760802 0.76 IDO1 (0.46)
SCHEMBL6558611 0.76 IDO1 (0.46)

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070135490-A1 Phenetanolamine derivatives GLAXO GROUP LIMITED (GB) 2007-06-14 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-20070135490-A1 Phenetanolamine derivatives ADRB2, ADRB1, ADRB3 GRM2 563/4885GRM3 555/4885TMEM97 561/4885

“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.