SCHEMBL4423217

SCHEMBL4423217

CC[Si](CC)(CC)O[C@H](c1cccc(OCC2CCCCC2)c1)[C@@H](C)CN1C(=O)c2ccccc2C1=O

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SIRT2 Q8IXJ6 1/20 0.39
DUT P33316 3/20 0.39
L3MBTL1 Q9Y468 1/20 0.37
MAOA P21397 1/20 0.37
MAOB P27338 1/20 0.37
GRM2 Q14416 1/20 0.37
FFAR1 O14842 4/20 0.37
PARP15 Q460N3 1/20 0.36
PARP10 Q53GL7 1/20 0.36

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
SCHEMBL2207489 0.92 DUT (0.41) DUTL3MBTL1MAOAMAOBGRM2
SCHEMBL4085382 0.84 DUT (0.41) SIRT2DUTL3MBTL1MAOAMAOB
SCHEMBL2209619 0.84 DUT (0.41) SIRT2DUTL3MBTL1MAOAMAOB
SCHEMBL4569091 0.83 PDE4B (0.43) GRM2FFAR1
SCHEMBL2207883 0.83 PDE4B (0.43) GRM2FFAR1
SCHEMBL2207890 0.83 PDE4B (0.43) GRM2FFAR1
SCHEMBL2207879 0.83 PDE4B (0.43) GRM2FFAR1
SCHEMBL2206778 0.83 MAOA (0.39) DUTMAOAMAOBGRM2
SCHEMBL2206773 0.83 MAOA (0.39) DUTMAOAMAOBGRM2
SCHEMBL2206779 0.83 MAOA (0.39) DUTMAOAMAOBGRM2

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-20090326074-A1 Alkoxy compounds for disease treatment ACUCELA INC. (US) 2009-12-31 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-20090326074-A1 Alkoxy compounds for disease treatment ALDH1A2, CLN6, AGER SIRT2 923/4885DUT 3010/4885L3MBTL1 2398/4885

“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.