SCHEMBL5425396

SCHEMBL5425396

C[Si](C)(C)CCOCN(COCC[Si](C)(C)C)S(=O)(=O)c1cccc(CC(=O)O)c1

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.41
TAS2R14 Q9NYV8 2/20 0.38
MAPK1 P28482 1/20 0.38
PTGDR2 Q9Y5Y4 2/20 0.37
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
CTSL P07711 1/20 0.36
CTSS P25774 1/20 0.36
ALDH1A1 P00352 3/20 0.36
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36
TP53 P04637 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
MAPT P10636 1/20 0.36
GAA P10253 1/20 0.36
TNF P01375 1/20 0.36
NOD1 Q9Y239 1/20 0.36
MEP1A Q16819 1/20 0.35
MEP1B Q16820 1/20 0.35

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
SCHEMBL924868 0.87 NPC1 (0.38) POLBTAS2R14MAPK1MEN1KMT2A
SCHEMBL5425873 0.85 POLB (0.37) POLBTAS2R14MAPK1KMT2ACTSL
SCHEMBL5281121 0.84 TAS2R14 (0.40) POLBTAS2R14MEN1KMT2ACTSL
SCHEMBL5429167 0.83 CYP4F2 (0.38) POLBTAS2R14MEN1KMT2AALDH1A1
SCHEMBL5284320 0.81 MAPK1 (0.43) TAS2R14MAPK1MEN1KMT2AMAPT
SCHEMBL5289935 0.76 NPC1 (0.40) POLBMAPK1MEN1KMT2AALDH1A1
SCHEMBL5325950 0.74 NPC1 (0.36) MAPK1ALDH1A1NPC1RAB9AMAPT
SCHEMBL4802351 0.74 MAPT (0.34) POLBMAPK1MEN1KMT2ACTSL
SCHEMBL18151491 0.74 RAB9A (0.62) MAPK1MEN1KMT2AALDH1A1NPC1
SCHEMBL19602565 0.74 CA1 (0.39) TAS2R14ALDH1A1NPC1RAB9ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070135490-A1 Phenetanolamine derivatives GLAXO GROUP LIMITED (GB) 2007-06-14 US disclosed
EP-1675821-A1 PHENETANOLAMINE DERIVATIVES GLAXO GROUP LIMITED (GB) 2006-07-05 EP disclosed
WO-2005044787-A1 PHENETANOLAMINE DERIVATIVES GLAXO GROUP LIMITED (GB) 2005-05-19 WO 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 POLB 2465/4885TAS2R14 2098/4885MAPK1 750/4885

“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.