SCHEMBL1968456

SCHEMBL1968456

CN(CCO[Si](C)(C)C(C)(C)C)C(=O)OC(C)(C)C

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 1/20 0.36
GBA1 P04062 1/20 0.35
CA14 Q9ULX7 1/20 0.31
HDAC1 Q13547 1/20 0.31
HDAC2 Q92769 1/20 0.31
HDAC6 Q9UBN7 1/20 0.31
CACNA1G O43497 1/20 0.31
CACNA1B Q00975 1/20 0.31
CACNA1C Q13936 1/20 0.31
AAK1 Q2M2I8 1/20 0.31
HTR2C P28335 1/20 0.30
SLC6A4 P31645 1/20 0.30

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
SCHEMBL17567264 0.91 DUT (0.35) PDK2GBA1
SCHEMBL24192721 0.91 GBA1 (0.35) PDK2GBA1
SCHEMBL3052574 0.90 GBA1 (0.34) PDK2GBA1CA14HDAC1HDAC2
SCHEMBL30234985 0.89 PDK2 (0.30) PDK2
SCHEMBL29549857 0.88 L3MBTL1 (0.36) PDK2GBA1CA14HDAC1HDAC2
SCHEMBL14680142 0.88 L3MBTL1 (0.36) PDK2GBA1CA14HDAC1HDAC2
SCHEMBL25977126 0.85 GBA1 (0.32) PDK2GBA1
SCHEMBL24192210 0.85 FPR3 (0.34) PDK2GBA1CA14HDAC1HDAC2
SCHEMBL16690585 0.82 CA14 (0.31) CA14HDAC1HDAC2HDAC6
SCHEMBL752426 0.81 GBA1 (0.33) GBA1HDAC1HDAC2HDAC6

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-20110166121-A1 FUSED HETEROCYCLIC COMPOUND LG LIFE SCIENCES LTD. (KR) 2011-07-07 US disclosed
US-20110166121-A1 FUSED HETEROCYCLIC COMPOUND LG LIFE SCIENCES LTD. (KR) 2011-07-07 US disclosed
EP-2334689-A2 FUSED HETEROCYCLIC COMPOUND LG Life Sciences Ltd. (KR) 2011-06-22 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-20110166121-A1 FUSED HETEROCYCLIC COMPOUND F2, PF4, F11 PDK2 422/4885GBA1 2782/4885CA14 3900/4885

“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.