SCHEMBL5425873

SCHEMBL5425873

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

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.37
CYP4F2 P78329 2/20 0.36
CYP4A11 Q02928 2/20 0.36
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36
TNF P01375 1/20 0.36
NOD1 Q9Y239 1/20 0.36
TAS2R14 Q9NYV8 1/20 0.36
ALDH1A1 P00352 5/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
TSHR P16473 1/20 0.36
MAPT P10636 2/20 0.34
TP53 P04637 1/20 0.34
RXFP1 Q9HBX9 2/20 0.34
LMNA P02545 1/20 0.34
ADRB2 P07550 1/20 0.34
ADRB1 P08588 1/20 0.34
ADRB3 P13945 1/20 0.34
MAPK1 P28482 2/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL5429167 0.93 CYP4F2 (0.38) POLBCYP4F2CYP4A11NPC1RAB9A
SCHEMBL924868 0.90 NPC1 (0.38) POLBNPC1RAB9ATNFNOD1
SCHEMBL5281121 0.85 TAS2R14 (0.40) POLBCYP4F2CYP4A11NPC1RAB9A
SCHEMBL5425396 0.85 POLB (0.41) POLBNPC1RAB9ATNFNOD1
SCHEMBL5289935 0.80 NPC1 (0.40) POLBNPC1RAB9ATNFNOD1
SCHEMBL5284320 0.79 MAPK1 (0.43) TAS2R14TSHRMAPTLMNAMAPK1
SCHEMBL5325950 0.78 NPC1 (0.36) NPC1RAB9ATNFNOD1ALDH1A1
SCHEMBL19602565 0.77 CA1 (0.39) NPC1RAB9ATAS2R14ALDH1A1SMN1; SMN2
SCHEMBL5284079 0.73 HIF1A (0.38) NPC1RAB9ATNFNOD1TAS2R14
SCHEMBL4802351 0.73 MAPT (0.34) POLBNPC1RAB9AALDH1A1SMN1; 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 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 POLB 2465/4885CYP4F2 278/4885CYP4A11 163/4885

“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.