SCHEMBL6336567

SCHEMBL6336567

CC(C)(C)[Si](OCC1C2CCC(=O)C21)(c1ccccc1)c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SMYD2 Q9NRG4 3/20 0.39
CYP3A4 P08684 1/20 0.35
HTT P42858 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
GRM5 P41594 1/20 0.34
GRM1 Q13255 1/20 0.34
BACE1 P56817 1/20 0.32

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
SCHEMBL6336564 1.00 SMYD2 (0.39) SMYD2CYP3A4HTTSMN1; SMN2GRM5
SCHEMBL29552957 0.82 SMYD2 (0.43) SMYD2CYP3A4HTTSMN1; SMN2GRM5
SCHEMBL23670531 0.82 SMYD2 (0.43) SMYD2CYP3A4HTTSMN1; SMN2GRM5
SCHEMBL19285174 0.82 SMYD2 (0.43) SMYD2CYP3A4HTTSMN1; SMN2GRM5
SCHEMBL5459617 0.81 SMYD2 (0.42) SMYD2CYP3A4HTTSMN1; SMN2GRM5
SCHEMBL5459611 0.81 SMYD2 (0.42) SMYD2CYP3A4HTTSMN1; SMN2GRM5
SCHEMBL6711402 0.81 SMYD2 (0.42) SMYD2CYP3A4HTTSMN1; SMN2GRM5
SCHEMBL9309383 0.79 SMYD2 (0.39) SMYD2CYP3A4HTTSMN1; SMN2GRM5
SCHEMBL16746036 0.77 SMYD2 (0.36) SMYD2CYP3A4HTTSMN1; SMN2
SCHEMBL16746031 0.77 SMYD2 (0.36) SMYD2CYP3A4HTTSMN1; 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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050203144-A1 Bicyclo[3.1.0]hexane containing oxazolidinone antibiotics and derivatives thereof KYORIN PHARMACEUTICAL CO., LTD. (JP) 2005-09-15 US disclosed
EP-1385834-B1 BICYCLO[3,1,0]HEXANE CONTAINING OXAZOLIDINONE ANTIBIOTIC AND DERIVATIVES THEREOF MERCK & CO INC (US) 2005-09-14 EP disclosed
US-6897230-B2 Bicyclo[3/1/0] hexane containing oxazolidinone antibiotics and derivatives thereof KYORIN PHARMACEUTICAL CO., LTD. (JP) 2005-05-24 US disclosed
EP-1385834-A1 BICYCLO[3,1,0]HEXANE CONTAINING OXAZOLIDINONE ANTIBIOTIC AND DERIVATIVES THEREOF Merck & Co., Inc. (US) 2004-02-04 EP disclosed
US-20030125367-A1 Bicyclo[3,1,0]hexane containing oxazolidinone antibioytics and derivatives thereof KYORIN PHARMACEUTICAL CO., LTD. 2003-07-03 US disclosed
WO-2003027083-A1 BICYCLO[3,1,0]HEXANE CONTAINING OXAZOLIDINONE ANTIBIOTIC AND DERIVATIVES THEREOF MERCK & CO., INC. (US) 2003-04-03 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 (2 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-20030125367-A1 Bicyclo[3,1,0]hexane containing oxazolidinone antibioytics and derivatives thereof NR4A1, NR0B1, NR1D1 SMYD2 4825/4885CYP3A4 170/4885HTT 1824/4885
US-20050203144-A1 Bicyclo[3.1.0]hexane containing oxazolidinone antibiotics and derivatives thereof NR0B1, NR4A1, VDR SMYD2 4868/4885CYP3A4 157/4885HTT 1733/4885

“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.