SCHEMBL5516521

SCHEMBL5516521

C[Si](C)(C)CC(NC(=O)c1cccc(I)c1)C(=O)O

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 1/20 0.45
HDAC2 Q92769 1/20 0.45
GRM5 P41594 1/20 0.45
MTOR P42345 2/20 0.43
TP53BP1 Q12888 1/20 0.43
MYC P01106 1/20 0.43
MAX P61244 1/20 0.43
GPR132 Q9UNW8 4/20 0.43
ALB P02768 1/20 0.42
IL2 P60568 1/20 0.42
GRN P28799 1/20 0.41
SORT1 Q99523 1/20 0.41
F2 P00734 1/20 0.41
PIN1 Q13526 1/20 0.41
AGTR2 P50052 2/20 0.41
FNTA P49354 1/20 0.41
FNTB P49356 1/20 0.41

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
SCHEMBL5516526 1.00 HDAC1 (0.45) HDAC1HDAC2GRM5MTORTP53BP1
SCHEMBL5514129 0.85 HDAC1 (0.44) HDAC1HDAC2GRM5MTORTP53BP1
SCHEMBL5514133 0.85 HDAC1 (0.44) HDAC1HDAC2GRM5MTORTP53BP1
SCHEMBL28088739 0.85 GPR132 (0.52) HDAC1HDAC2GRM5MTORTP53BP1
SCHEMBL26263203 0.85 GPR132 (0.52) HDAC1HDAC2GRM5MTORTP53BP1
SCHEMBL26264263 0.82 CA2 (0.51) HDAC1HDAC2MTORTP53BP1MYC
SCHEMBL17680606 0.78 NPSR1 (0.59) HDAC1HDAC2GRM5MTORTP53BP1
SCHEMBL5520008 0.78 CTSL (0.57)
SCHEMBL5520013 0.78 CTSL (0.57)
SCHEMBL5582056 0.77 CTSB (0.39) HDAC1HDAC2GRM5MTORTP53BP1

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-20070088001-A1 Silinane compounds as cysteine protease inhibitors QUEST DIAGNOSTICS INVESTMENTS LLC 2007-04-19 US disclosed
EP-1716158-A2 SILINANE COMPOUNDS AS CYSTEINE PROTEASE INHIBITORS Schering Aktiengesellschaft (DE) 2006-11-02 EP disclosed
WO-2005074904-A2 SILINANE COMPOUNDS AS CYSTEINE PROTEASE INHIBITORS SCHERING AKTIENGESELLSCHAFT (DE) 2005-08-18 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-20070088001-A1 Silinane compounds as cysteine protease inhibitors CTSV, CTSB, CTSS HDAC1 558/4885HDAC2 680/4885GRM5 4265/4885

“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.